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4-(Methylthio)benzenethiol

4-(Methylthio)benzenethiol structure

CAS No:
1122-97-0
Formula:
C7H8S2
Chemical Name:
4-(Methylthio)benzenethiol
Synonyms:
Benzenethiol,4-(methylthio)-;Benzenethiol,p-(methylthio)-;4-(Methylthio)benzenethiol;4-(Methylthio)phenyl mercaptan;p-(Methylthio)benzenethiol;4-(Methylsulfanyl)thiophenol;4-(Methylsulfanyl)benzenethiol;4-Methylsulfanylbenzenthiol
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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4-(Methylthio)benzenethiol Basic Attributes

Molecular Weight：

156.27

Exact Mass：

156.27

BRN：

1931500

DSSTox ID：

DTXSID90149957

HScode：

2930909090

Characteristics

PSA：

26.3

XLogP3：

3.01

Appearance：

WHITE TO YELLOW SOLID, CRYSTALS AND/OR CHUNKS OR COLORLESS TO YELLOW LIQUID

Density：

1.19

Melting Point：

40-43 °C

Boiling Point：

93-95 °C @ Press: 1.5 Torr

Flash Point：

>230 °F

Refractive Index：

1.653

Vapor Pressure：

0.03mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

2810

wgk germany：

hazard class code：

36-43

safety instructions：

26-36/37

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338-P342 + P311

Hazard Statements：

H319-H334

GHS Classification：

|Danger|H302 (11.63%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P280, P285, P301+P312, P302+P352, P304+P341, P305+P351+P338, P321, P330, P332+P313, P337+P313, P342+P311, P362, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:156.3
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:156.00674260
Monoisotopic Mass:156.00674260
Topological Polar Surface Area:26.3
Heavy Atom Count:9
Complexity:75
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4-(METHYLTHIO)THIOPHENOL

CAS No.: 1122-97-0

Grade: industrial Grade

Content: 98%

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Guide of 4-(Methylthio)benzenethiol

Basic Attributes
Characteristics
Safety Information
Computed Properties
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4-(Methylthio)benzenethiol

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