2,5-Dimethylphenol

Modify Date: 2026-07-16 15:24:29

2,5-Dimethylphenol structure	Common Name	2,5-Dimethylphenol
	CAS Number	95-87-4	Molecular Weight	122.164
	Density	1.0±0.1 g/cm3	Boiling Point	211.1±0.0 °C at 760 mmHg
	Molecular Formula	C₈H₁₀O	Melting Point	75-77 °C
	MSDS	Chinese USA	Flash Point	86.7±7.2 °C
	Symbol	GHS05, GHS06, GHS09	Signal Word	Danger

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

Name	2,5-Dimethylphenol
Synonym	More Synonyms

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

Density	1.0±0.1 g/cm3
Boiling Point	211.1±0.0 °C at 760 mmHg
Melting Point	75-77 °C
Molecular Formula	C₈H₁₀O
Molecular Weight	122.164
Flash Point	86.7±7.2 °C
Exact Mass	122.073166
PSA	20.23000
LogP	2.40
Vapour Pressure	0.1±0.4 mmHg at 25°C
Index of Refraction	1.540
InChIKey	NKTOLZVEWDHZMU-UHFFFAOYSA-N
SMILES	Cc1ccc(C)c(O)c1
Water Solubility	1 g/100 mL (60 ºC)

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

2,5-Dimethylphenol MSDS(Chinese)

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

CHEMICAL IDENTIFICATION

RTECS NUMBER :: ZE5775000

CHEMICAL NAME :: 2,5-Xylenol

CAS REGISTRY NUMBER :: 95-87-4

BEILSTEIN REFERENCE NO. :: 1099260

LAST UPDATED :: 199710

DATA ITEMS CITED :: 8

MOLECULAR FORMULA :: C8-H10-O

MOLECULAR WEIGHT :: 122.18

WISWESSER LINE NOTATION :: QR B1 E1

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 :: 444 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: GTPPAF Gigiena Truda i Professional'naya Patologiya v Estonskoi SSR. Labor Hygiene and Occupational Pathology in the Estonian SSR. (Institut Eksperimental'noi i Klinicheskoi Meditsiny Ministerstva Zdravookhraneniya Estonskoi SSR, Tallinn, USSR) V.8- 1972- Volume(issue)/page/year: 8,145,1972

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Unreported

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 730 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 53,227,1935

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 383 mg/kg

TOXIC EFFECTS :: Behavioral - ataxia Behavioral - muscle contraction or spasticity Lungs, Thorax, or Respiration - dyspnea

REFERENCE :: HYSAAV Hygiene and Sanitation (USSR). English translation of GISAAA. (Springfield, VA) 1964-71. Discontinued. Volume(issue)/page/year: 33(7-9),329,1968

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: 938 mg/kg

TOXIC EFFECTS :: Behavioral - ataxia Behavioral - muscle contraction or spasticity Lungs, Thorax, or Respiration - dyspnea

REFERENCE :: HYSAAV Hygiene and Sanitation (USSR). English translation of GISAAA. (Springfield, VA) 1964-71. Discontinued. Volume(issue)/page/year: 33(7-9),329,1968 ** TUMORIGENIC DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 4000 mg/kg/20W-I

TOXIC EFFECTS :: Tumorigenic - equivocal tumorigenic agent by RTECS criteria Skin and Appendages - tumors

REFERENCE :: CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 19,413,1959

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

Symbol	GHS05, GHS06, GHS09
Signal Word	Danger
Hazard Statements	H301-H311-H314-H411
Precautionary Statements	P273-P280-P301 + P310-P305 + P351 + P338-P310
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	T:Toxic;N:Dangerousfortheenvironment;
Risk Phrases	R24/25;R34;R51/53
Safety Phrases	S26-S36/37/39-S45-S61
RIDADR	UN 2261 6.1/PG 2
WGK Germany	3
RTECS	ZE5775000
Packaging Group	II
Hazard Class	6.1
HS Code	2907199090

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

This table lists upstream starting materials and downstream derivative products related to this chemical.

Precursor 10
CAS#:106-42-3 p-Xylene CAS#:95-72-7 2-Chloro-1,4-di... CAS#:201230-82-2 carbon monoxide CAS#:85199-06-0 2,5-Dimethylphe...
CAS#:1122-42-5 2-Iodo-1,4-dime... CAS#:70500-83-3 5-methyl-2-(pip... CAS#:78998-97-7 2,4,5-tribromo-... CAS#:67-56-1 Methanol
CAS#:108-39-4 m-Cresol CAS#:132907-18-7 1,4-dimethoxy-1...
DownStream 10
CAS#:10496-93-2 4-(hydroxymethy... CAS#:110047-13-7 (2,5-dimethylph... CAS#:496-78-6 2,4,5-TRIMETHYL... CAS#:31264-51-4 3-(2,5-XYLYLOXY...
CAS#:3245-55-4 2-(3-Bromopropo... CAS#:636-94-2 2-Hydroxytereph... CAS#:50-85-1 2-Hydroxy-4-met... CAS#:50984-88-8 p-xylenolphthalein
CAS#:17994-01-3 (2,5-dimethylph... CAS#:20294-63-7 2,5-dimethyl-4-...

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

HS Code	2907199090
Summary	2907199090 other monophenols VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

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

Calculating virtual log P in the alkane/water system (log P(N)(alk)) and its derived parameters deltalog P(N)(oct-alk) and log D(pH)(alk).

J. Med. Chem. 48 , 3269-79, (2005)

Growing interest in the use of both the logarithm of the partition coefficient of the neutral species in the alkane/water system (log P(N)(alk)) and the difference between log P(N)(oct) (the logarithm...

Discovery of novel SERCA inhibitors by virtual screening of a large compound library.

Eur. J. Med. Chem. 46 , 1512-23, (2011)

Two screening protocols based on recursive partitioning and computational ligand docking methodologies, respectively, were employed for virtual screens of a compound library with 345,000 entries for n...

Effect of p-xylene metabolites, p-methylbenzyl alcohol and 2,5-dimethylphenol, on rat hepatic and pulmonary microsomal metabolism.

Res. Commun. Chem. Pathol. Pharmacol. 76(1) , 117-20, (1992)

Pulmonary metabolites of p-xylene, p-methylbenzyl alcohol (PMBA) and 2,5-dimethylphenol (DMP), were employed to investigate the divergent effects of p-xylene on pulmonary and hepatic metabolism. Rats ...

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

2,5-Dimethyl-Phenol

2, 5-Dimethylphenol

EINECS 202-461-5

2,4-DIMORPHOLINO-6-(2-THIENYL)OXADIAZINIUM TETRACHLOROFERRATE

2,5-dimethyl-phenethylamin

2,5-DIMETHYL PHENOL OR 2,5-XYLENOL

2,5-DIMETHYL PHENOL

2,5-Dimethyl-phenaethylamin

2,5-DIMETHYLPHENOL FOR SYNTHESIS

2,5-dimethyl-phenethylamine

RARECHEM AL BW 0330

2,5-Dimethylbenzolol

2,5-DiMethylphenethylaMine 1GR

2,5-XYLENOL (OH=1)

2,5-xylenol

2,5-DIMETHYLPHENOL/2,5-XYLENOL

3,6-dimethylphenol

2.5-DIMETHYL PHENOL

2,5-Dimethylphenol

2,5-DIMETHYPHENOL

p-cumyl phenol

Entacapone

2,5-Dimethylbenzeneethanamine

MFCD00002237

2,5-DIMETHYLPHENOL (2,5-XYLENOL)

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 2,5-Dimethylphenol?

A: Related upstream materials(CAS) of 2,5-Dimethylphenol: 106-42-3;95-72-7;201230-82-2;85199-06-0;1122-42-5;70500-83-3;78998-97-7;67-56-1;108-39-4;132907-18-7.

Q: What is the CAS number of 2,5-Dimethylphenol?

A: CAS number of 2,5-Dimethylphenol is 95-87-4.

Q: What is the molecular weight of 2,5-Dimethylphenol?

A: Molecular weight of 2,5-Dimethylphenol is 122.164.

Q: What is the safety information for 2,5-Dimethylphenol?

A: Safety information for 2,5-Dimethylphenol: S26-S36/37/39-S45-S61.

Q: What is the boiling point of 2,5-Dimethylphenol?

A: Boiling point of 2,5-Dimethylphenol is 211.1±0.0 °C at 760 mmHg.

Q: What is the molecular formula of 2,5-Dimethylphenol?

A: Molecular formula of 2,5-Dimethylphenol is C8H10O.

Q: What is the LogP of 2,5-Dimethylphenol?

A: LogP of 2,5-Dimethylphenol is 2.40.

Q: What is the polar surface area (PSA) of 2,5-Dimethylphenol?

A: Polar surface area (PSA) of 2,5-Dimethylphenol is 20.23000.

Q: How is the water solubility of 2,5-Dimethylphenol?

A: Water solubility of 2,5-Dimethylphenol: 1 g/100 mL (60 ºC).

Q: What are the downstream products of 2,5-Dimethylphenol?

A: Related downstream products(CAS) of 2,5-Dimethylphenol: 10496-93-2;110047-13-7;496-78-6;31264-51-4;3245-55-4;636-94-2;50-85-1;50984-88-8;17994-01-3;20294-63-7.

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.

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.

Shanghai Nianxing Industrial Co., Ltd
China
Product Name: 2,5-Dimethylphenol
Price: Check
Purity: 99.8%
Delivery: 10 Day
Contact: Yang
Email: sales@echemcloud.com

Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 2,5-Dimethylphenol
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Delivery: Inquiry
Contact: Ms Wang
Email: enquiry@dycnchem.com

Henan Tianfu Chemical Co., Ltd.
China
Product Name: 2,5-Dimethylphenol
Price: $Inquiry/1kg $Inquiry/25kg $Inquiry/1000kg $Inquiry/10ton
Purity: 99.0%
Delivery: Inquiry
Contact: Anson
Email: info@tianfuchem.com

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2,5-Dimethylphenol

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2,5-Dimethylphenol | FAQ

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