4′-(1H-1,2,4-triazol-1-yl)phenol

Modify Date: 2024-01-14 20:12:47

4′-(1H-1,2,4-triazol-1-yl)phenol Structure
4′-(1H-1,2,4-triazol-1-yl)phenol structure
Common Name 4′-(1H-1,2,4-triazol-1-yl)phenol
CAS Number 68337-15-5 Molecular Weight 161.16100
Density 1.32g/cm3 Boiling Point 371.4ºC at 760 mmHg
Molecular Formula C8H7N3O Melting Point 254-257 °C
MSDS N/A Flash Point 178.4ºC

 Names

Name 4-(1,2,4-Triazol-1-yl)Phenol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.32g/cm3
Boiling Point 371.4ºC at 760 mmHg
Melting Point 254-257 °C
Molecular Formula C8H7N3O
Molecular Weight 161.16100
Flash Point 178.4ºC
Exact Mass 161.05900
PSA 50.94000
LogP 0.97290
Index of Refraction 1.665

 MSDS

Name: 4 -(1H-1 2 4-Triazol-1-yl)phenol 98% Material Safety Data Sheet
Synonym: None
CAS: 68337-15-5
Section 1 - Chemical Product MSDS Name:4 -(1H-1 2 4-Triazol-1-yl)phenol 98% Material Safety Data Sheet
Synonym:None

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
68337-15-5 4'-(1H-1,2,4-Triazol-1-yl)phenol 98 269-845-2
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Not available.
Potential Health Effects
Eye:
Causes eye irritation. May cause chemical conjunctivitis.
Skin:
Causes skin irritation.
Ingestion:
May cause gastrointestinal irritation with nausea, vomiting and diarrhea.
Inhalation:
Causes respiratory tract irritation. Can produce delayed pulmonary edema.
Chronic:
Effects may be delayed.

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

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.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or appropriate foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Sweep up, then place into a suitable container for disposal. Avoid generating dusty conditions. Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Avoid ingestion and inhalation. Use with adequate ventilation.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 68337-15-5: 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 prevent skin exposure.
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: Powder
Color: beige brown
Odor: none reported
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 254.00 - 257.00 deg C
Autoignition Temperature: Not applicable.
Flash Point: Not applicable.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature: Not available.
Solubility in water: Not available.
Specific Gravity/Density: Not available.
Molecular Formula: C8H7N3O
Molecular Weight: 161.16

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Incompatible materials, excess heat, strong oxidants.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 68337-15-5 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
4'-(1H-1,2,4-Triazol-1-yl)phenol - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION


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

Section 14 - TRANSPORT INFORMATION

IATA
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 68337-15-5: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 68337-15-5 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 68337-15-5 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Hazard Codes Xi
Risk Phrases R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Phrases S24/25
HS Code 2933990090

 Synthetic Route

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4′-(1H-1,2,4-triazol-1-yl)phenol Structure

4′-(1H-1,2,4-tr...

CAS#:68337-15-5

Literature: Acta Crystallographica Section C: Crystal Structure Communications, , vol. 55, # 7 p. 1160 - 1163

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4′-(1H-1,2,4-triazol-1-yl)phenol Structure

4′-(1H-1,2,4-tr...

CAS#:68337-15-5

Literature: Acta Crystallographica Section C: Crystal Structure Communications, , vol. 55, # 7 p. 1160 - 1163

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

EINECS 269-845-2
MFCD00003096
4-(1,2,4-triazol-1-yl)phenol
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