4-Nonylphenol

Modify Date: 2026-06-30 23:49:53

4-Nonylphenol Structure
4-Nonylphenol structure
Common Name 4-Nonylphenol
CAS Number 104-40-5 Molecular Weight 220.350
Density 0.9±0.1 g/cm3 Boiling Point 330.6±11.0 °C at 760 mmHg
Molecular Formula C15H24O Melting Point 43-44°C
MSDS Chinese USA Flash Point 184.2±9.4 °C
Symbol GHS05 GHS07 GHS08 GHS09
GHS05, GHS07, GHS08, GHS09
Signal Word Danger

Summary: 4-Nonylphenol, also known as 对壬基酚, has a CAS number of 104-40-5. Its molecular formula is C15H24O and molecular weight is 220.350. This substance is a viscous, colorless liquid with a phenolic odor, melting point of 43-44°C, boiling point of 330.6±11.0°C, and density of 0.9±0.1g/cm³. For research-use only, not for medical or clinical usage.


 Names

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name 4-nonylphenol
Synonym More Synonyms

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density 0.9±0.1 g/cm3
Boiling Point 330.6±11.0 °C at 760 mmHg
Melting Point 43-44°C
Molecular Formula C15H24O
Molecular Weight 220.350
Flash Point 184.2±9.4 °C
Exact Mass 220.182709
PSA 20.23000
LogP 6.19
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.505
InChIKey IGFHQQFPSIBGKE-UHFFFAOYSA-N
SMILES CCCCCCCCCc1ccc(O)cc1
Storage condition APPROX 20°C
Stability Stable. Incompatible with strong oxidizing agents.

 MSDS

This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.

Name: 4-Nonylphenol 99% (GC) Mixture of Isomers Material Safety Data Sheet
Synonym: p-Nonylphenol
CAS: 104-40-5
Section 1 - Chemical Product MSDS Name:4-Nonylphenol 99% (GC) Mixture of Isomers Material Safety Data Sheet
Synonym:p-Nonylphenol

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
104-40-5 4-Nonylphenol 99 203-199-4
Hazard Symbols: XI
Risk Phrases: 43 53

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
May cause sensitization by skin contact. May cause long-term adverse effects in the aquatic environment.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. May cause skin sensitization, an allergic reaction, which becomes evident upon re-exposure to this material.
Ingestion:
May cause digestive tract disturbances. May be harmful if swallowed.
Inhalation:
May cause respiratory tract irritation.
Chronic:
No information found.

Section 4 - FIRST AID MEASURES
Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately.
Skin:
Get medical aid. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Wash clothing before reuse.
Ingestion:
If victim is conscious and alert, give 2-4 cupfuls of milk or water.
Never give anything by mouth to an unconscious person. Get medical aid immediately.
Inhalation:
Get medical aid immediately. Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Use water spray to keep fire-exposed containers cool. Containers may explode in the heat of a fire.
Extinguishing Media:
Use agent most appropriate to extinguish fire. Cool containers with flooding quantities of water until well after fire is out. Use water fog, dry chemical, carbon dioxide or alcohol type foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container. Clean up spills immediately, observing precautions in the Protective Equipment section. Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Avoid contact with eyes, skin, and clothing. Avoid ingestion and inhalation.
Storage:
Keep container closed when not in use. Store in a cool, dry, well-ventilated area away from incompatible substances.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Use process enclosure, local exhaust ventilation, or other engineering controls to control airborne levels.
Exposure Limits CAS# 104-40-5: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to minimize contact with skin.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Liquid
Color: clear pale yellow
Odor: phenol-like
pH: Not available.
Vapor Pressure: 0.109 Pa @ 25C
Viscosity: Not available.
Boiling Point: 293 - 297 deg C @ 760.00mm Hg
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: 141 deg C ( 285.80 deg F)
Explosion Limits, lower: N/A
Explosion Limits, upper: N/A
Decomposition Temperature:
Solubility in water: Slightly soluble.
Specific Gravity/Density: .9450g/cm3
Molecular Formula: C15H24O
Molecular Weight: 220.35

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, strong oxidants.
Incompatibilities with Other Materials:
Strong oxidizing agents, acids.
Hazardous Decomposition Products:
Carbon monoxide, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Not available.

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 104-40-5: SM5630000 LD50/LC50:
CAS# 104-40-5: Oral, rat: LD50 = 1620 mg/kg.
Carcinogenicity:
4-Nonylphenol - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

Section 12 - ECOLOGICAL INFORMATION
Other No information available.

Section 13 - DISPOSAL CONSIDERATIONS
Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION

IATA
Shipping Name: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, LIQUID, N.O.S
.*
Hazard Class: 9
UN Number: 3082
Packing Group: III
IMO
Shipping Name: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, LIQUID, N.O.S
.
Hazard Class: 9
UN Number: 3082
Packing Group: III
RID/ADR
Shipping Name: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, LIQUID, N.O.S
.
Hazard Class: 9
UN Number: 3082
Packing group: III

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 43 May cause sensitization by skin contact.
R 53 May cause long-term adverse effects in the
aquatic environment.
Safety Phrases:
S 24 Avoid contact with skin.
S 37 Wear suitable gloves.
S 61 Avoid release to the environment. Refer to
special instructions/safety data sheets.
WGK (Water Danger/Protection)
CAS# 104-40-5: 3
Canada
CAS# 104-40-5 is listed on Canada's DSL List.
CAS# 104-40-5 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 104-40-5 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Toxicological Information

This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SM5630000
CHEMICAL NAME :
Phenol, p-nonyl-
CAS REGISTRY NUMBER :
104-40-5
BEILSTEIN REFERENCE NO. :
2047450
LAST UPDATED :
199710
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C15-H24-O

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1620 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: PB85-143766 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X6956 No. of Facilities: 1009 (estimated) No. of Industries: 10 No. of Occupations: 17 No. of Employees: 16739 (estimated) No. of Female Employees: 3822 (estimated)

 Safety Information

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

Symbol GHS05 GHS07 GHS08 GHS09
GHS05, GHS07, GHS08, GHS09
Signal Word Danger
Hazard Statements H302-H314-H361-H411
Precautionary Statements P260-P280-P301 + P312 + P330-P303 + P361 + P353-P304 + P340 + P310-P305 + P351 + P338
Personal Protective Equipment Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges
Hazard Codes C: Corrosive;
Risk Phrases R22;R34;R52/53
Safety Phrases S26-S36/37/39-S45-S61-S60
RIDADR UN 3145 8/PG 2
WGK Germany 3
RTECS SM5650000
Packaging Group III
Hazard Class 8
HS Code 2907131000

 Synthetic Route

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

~85%

4-Nonylphenol Structure

4-Nonylphenol

CAS#:104-40-5

Learn More
Literature: Corti, A.; Frassinetti, S.; Vallini, G.; D'Antone, S.; Fichi, C.; Solaro, R. Environmental Pollution (Amsterdam, Netherlands), 1995 , vol. 90, # 1 p. 83 - 88

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4-Nonylphenol Structure

4-Nonylphenol

CAS#:104-40-5

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Literature: WO2004/54954 A1, ; Page 14 ;

~%

4-Nonylphenol Structure

4-Nonylphenol

CAS#:104-40-5

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Literature: Chemical and Pharmaceutical Bulletin, , vol. 37, # 6 p. 1619 - 1621

~%

4-Nonylphenol Structure

4-Nonylphenol

CAS#:104-40-5

Learn More
Literature: Chemical and Pharmaceutical Bulletin, , vol. 37, # 6 p. 1619 - 1621

~99%

4-Nonylphenol Structure

4-Nonylphenol

CAS#:104-40-5

Learn More
Literature: Ohsawa; Hatano; Kayoh; Kotabe; Oishi Tetrahedron Letters, 1992 , vol. 33, # 38 p. 5555 - 5558

~%

4-Nonylphenol Structure

4-Nonylphenol

CAS#:104-40-5

Learn More
Literature: Journal fuer Praktische Chemie (Leipzig), , vol. 331, # 4 p. 617 - 630

~%

4-Nonylphenol Structure

4-Nonylphenol

CAS#:104-40-5

Learn More
Literature: Environmental Pollution (Amsterdam, Netherlands), , vol. 90, # 1 p. 83 - 88

~%

4-Nonylphenol Structure

4-Nonylphenol

CAS#:104-40-5

Learn More
Literature: Xenobiotica, , vol. 28, # 8 p. 745 - 757

 Customs

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code 2907131000
Summary 2907131000 4-nonylphenol。supervision conditions:x(environment control release notice for poisonous chemicals)。VAT:17.0%。tax rebate rate:9.0%。MFN tarrif:5.5%。general tariff:30.0%

 Articles47

More Articles

This table lists relevant public references with title, journal and publication metadata for this compound.

BFCOD activity in fish cell lines and zebrafish embryos and its modulation by chemical ligands of human aryl hydrocarbon and nuclear receptors.

Environ. Sci. Pollut. Res. Int. 22 , 16393-404, (2015)

Assessment of exposure and effect of fish to pharmaceuticals that contaminate aquatic environment is a current major issue in ecotoxicology and there is a need to develop specific biological marker to...

Occurrence of endocrine-disrupting phenols and estrogens in water and sediment of the Songhua river, northeastern China.

Arch. Environ. Contam. Toxicol. 66(3) , 361-9, (2014)

Concentrations of six phenolic endocrine-disrupting chemicals [4-tert-octylphenol (OP), 4-t-nonylphenol (4-t-NP), 4-n-nonylphenol (4-n-NP), nonylphenol mono- to di-ethoxylates (NP1EO, NP2EO), and bisp...

Binding of the endocrine disruptors 4-tert-octylphenol and 4-nonylphenol to human serum albumin.

J. Hazard. Mater. 248-249 , 347-54, (2013)

Alkylphenols, considered to be endocrine disruptor chemicals and toxic environmental priority pollutants, pose great threats to humans with wide exposure from food and other potential sources. In this...

 4-NonylphenolBioassay

View more

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

Name: Ratio of kcat/Km determined for catalytic efficiency in sulfonation against AST IV
Source: ChEMBL
Target: Sulfotransferase 1A1
External Id: CHEMBL846524
Name: Cell Viability Profiling of Human Lymphoblast Cell Lines
Source: NCGC
Target: N/A
External Id: HAPV101
Name: Caspase-3/7 Activation Profiling of Human Lymphoblast Cell Lines
Source: NCGC
Target: N/A
External Id: HAPC101
Name: qHTS assay to identify small molecule inhibitors of firefly luciferase
Source: 824
Target: firefly luciferase
External Id: LUC790
Total 385, Current Page 1 of 39
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 Synonyms

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

4-Nonylbenzolol
4-Nonyl phenol
4-n-nonylphenol
EINECS 203-199-4
4-Nonylphenol
MFCD00002396

 4-Nonylphenol | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What are the upstream materials of 4-nonylphenol?
A: Related upstream materials(CAS) of 4-nonylphenol: 14392-69-9;32604-44-7;4397-53-9;111-83-1;32588-84-4;764-85-2;108-95-2;103526-64-3.
Q: What English synonyms does 4-nonylphenol have?
A: English synonyms of 4-nonylphenol: 4-Nonylbenzolol, 4-Nonyl phenol, 4-n-nonylphenol, EINECS 203-199-4, 4-Nonylphenol, MFCD00002396.
Q: What is the polar surface area (PSA) of 4-nonylphenol?
A: Polar surface area (PSA) of 4-nonylphenol is 20.23000.
Q: What is the boiling point of 4-nonylphenol?
A: Boiling point of 4-nonylphenol is 330.6±11.0 °C at 760 mmHg.
Q: What is the LogP of 4-nonylphenol?
A: LogP of 4-nonylphenol is 6.19.
Q: What is the InChIKey of 4-nonylphenol?
A: InChIKey of 4-nonylphenol is IGFHQQFPSIBGKE-UHFFFAOYSA-N.
Q: What is the SMILES notation of 4-nonylphenol?
A: SMILES notation of 4-nonylphenol is CCCCCCCCCc1ccc(O)cc1.
Q: What is the English name of 4-nonylphenol?
A: The English name of 4-nonylphenol is 4-nonylphenol.
Q: What are the storage conditions for 4-nonylphenol?
A: Storage conditions for 4-nonylphenol: APPROX 20°C.
Q: What is the CAS number of 4-nonylphenol?
A: CAS number of 4-nonylphenol is 104-40-5.

 4-Nonylphenolfactory

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Shanghai Nianxing Industrial Co., Ltd
Dayang Chem (Hangzhou) Co., Ltd.
Henan Tianfu Chemical Co., Ltd.
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