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4946-13-8

Basic Information
CAS No.: 4946-13-8
Name: 4-ETHYLTHIOPHENOL
Article Data: 6
Molecular Structure:
Molecular Structure of 4946-13-8 (4-ETHYLTHIOPHENOL)
Formula: C8H10S
Molecular Weight: 138.233
Synonyms: Benzenethiol,p-ethyl- (6CI,7CI,8CI);4-Ethylbenzenethiol;4-Ethylthiophenol;p-Ethylbenzenethiol;p-Ethylphenylmercaptan;p-Ethylthiophenol;
EINECS: -0
Density: 1.024 g/cm3
Melting Point: -30°C (estimate)
Boiling Point: 211.7 ºC at 760 mmHg
Flash Point: 84 ºC
Appearance: clear, colorless liquid
Hazard Symbols:
Risk Codes: R20/21/22-36/37/38
Safety: S26-36/37/39
PSA: 38.80000
LogP: 2.53770
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    4-Ethyl thiophenol

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  • 4-Ethylthiophenol 4946-13-8

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    4-Ethylthiophenol 4946-13-8

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  • 4-ETHYLTHIOPHENOL

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    4946-13-8

    4-ETHYLTHIOPHENOL

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Chemistry


IUPAC Name: 4-Ethylbenzenethiolate 
SMILES: Sc1ccc(cc1)CC
InChI: InChI=1/C8H10S/c1-2-7-3-5-8(9)6-4-7/h3-6,9H,2H2,1H3
InChIKey: WWQQPHUHTAZWDH-UHFFFAOYAS 
Empirical Formula: C8H10S
Molecular Weight: 138.23 
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 2
Index of Refraction: 1.565
Molar Refractivity: 43.97 cm3
Molar Volume: 134.8 cm3
Surface Tension: 36.8 dyne/cm
Density: 1.024 g/cm3
Flash Point: 84 °C
Enthalpy of Vaporization: 42.97 kJ/mol
Boiling Point: 211.7 °C at 760 mmHg
Vapour Pressure: 0.262 mmHg at 25 °C
Sensitive: Air Sensitive
Appearance: clear,  colorless liquid
Product Categories of Benzenethiol, 4-ethyl- (CAS NO.4946-13-8): Phenol & Thiophenol & Mercaptan; Phenoles and thiophenoles

Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 20/21/22-36/37/38 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed. 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
HazardClass of Benzenethiol, 4-ethyl- (CAS NO.4946-13-8): IRRITANT, AIR SENSITIVE, STENCH

Specification

 2,5-Dimethyl thiophenol (CAS NO.4001-61-0), its Synonyms are Benzenethiol, 2,5-dimethyl- ; 2,5-Dimethylbenzenethiol .