4-Ethylbenzenethiol

Basic Information

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CAS Number

4946-13-8

Molecular Formula

C8H10S

Molecular Weight

138.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

-30°C (estimate)

Boiling Point

211°C

Flash Point

119-120°C/30mm

Refractive Index

1.563

SMILES

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CCC1=CC=C(C=C1)S

InChI

InChI=1S/C8H10S/c1-2-7-3-5-8(9)6-4-7/h3-6,9H,2H2,1H3

InChIKey

WWQQPHUHTAZWDH-UHFFFAOYSA-N

LogP

2.537700000000001

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

72.6

Safety Information

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Hazard Statement

H227 Combustible liquid
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Class AIR SENSITIVE Class AIR SENSITIVE

Class STENCH Class STENCH

Sensitiveness

Air Sensitive

Synonyms & References

English

4-Ethylphenyl mercaptan
DTXSID40374550
4-Ethylthiophenol
4-Ethyl thiophenol
E0672
4-ethylbenzenethiol
AS-75932
EN300-85718
4-Ethylthiophenol, AldrichCPR
AKOS005206838
H11883
Benzenethiol, 4-ethyl-
F8882-1203
SCHEMBL186324
p-ethylphenylmercaptan
4-ethylbenzene-1-thiol
CS-0296669
MFCD00040229
4946-13-8
p-ethylphenyl mercaptan
J-515302
FT-0618427
p-ethylthiophenol
4-Ethylbenzenethiol

MDL Number

MFCD00040229

Customs Code

2930909090

FAQ

What is 4-Ethylbenzenethiol (CAS: 4946-13-8)?

4-Ethylbenzenethiol is a sulfur-containing organic compound with the molecular formula C<sub>8</sub>H<sub>11</sub>SH. It has a distinctive odor and is used in various applications due to its chemical properties. The CAS number is 4946-13-8.

What are the main uses of 4-Ethylbenzenethiol (CAS: 4946-13-8)?

4-Ethylbenzenethiol is primarily used in industrial applications such as rubber vulcanization accelerators, antioxidant additives, and flavoring agents in the food industry. It is also utilized in the synthesis of other chemicals and as a reagent in research settings.

Is 4-Ethylbenzenethiol (CAS: 4946-13-8) safe?

4-Ethylbenzenethiol can be hazardous if not handled properly. It is flammable and may cause skin and eye irritation. Proper safety equipment, such as gloves and goggles, should be worn. It is important to follow all safety guidelines and avoid inhalation or contact with the skin and eyes.

How should 4-Ethylbenzenethiol (CAS: 4946-13-8) be stored?

4-Ethylbenzenethiol should be stored in a cool, dry place away from direct sunlight and sources of ignition. It should be kept in a tightly sealed container to prevent evaporation. The storage temperature should be below 25°C (77°F) to maintain its stability and safety. Avoid exposure to moisture and humidity.