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Methyl p-tolyl sulfide

Methyl p-tolyl sulfide structure

CAS No:
623-13-2
Formula:
C8H10S
Chemical Name:
Methyl p-tolyl sulfide
Synonyms:
Benzene,1-methyl-4-(methylthio)-;Sulfide,methyl p-tolyl;1-Methyl-4-(methylthio)benzene;4-(Methylthio)toluene;p-(Methylthio)toluene;p-Methylphenyl methyl sulfide;Methyl 4-methylphenyl sulfide;p-Tolyl methyl sulfide;p-Methylthioanisole;4-Methylthioanisole;Methyl p-tolyl sulfide;Methyl p-methylphenyl sulfide;NSC 6256;Methyl 4-tolyl sulfane;(4-Methylphenyl) methyl sulfide;Methyl p-tolylthioether;4-(Methylsulfanyl)toluene;1-Methyl-4-(methylsulfanyl)benzene;87494-89-1
Categories:
Chemical Reagents > Organic Reagents

Description

clear colorless to light yellow liquid

Methyl p-tolyl sulfide is an aryl sulfide that is thioanisole in which the hydrogen at the para position has been replaced by a methyl group. It is an aryl sulfide and a member of toluenes.

Methyl p-tolyl sulfide Basic Attributes

Molecular Weight：

138.23

Exact Mass：

138.23

BRN：

1905733

EC Number：

210-773-8

NSC Number：

6256

DSSTox ID：

DTXSID6060765

HScode：

2930909090

Characteristics

PSA：

25.3

XLogP3：

3.16

Appearance：

clear colorless to light yellow liquid

Density：

1.0302 g/cm³ @ Temp: 16 °C

Boiling Point：

94 °C @ Press: 31 Torr

Flash Point：

185 °F

Refractive Index：

1.559

Safety Information

Hazard category：

Transport codes：

3334

wgk germany：

hazard class code：

safety instructions：

24/25

Marks：

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 40 companies from 2 notifications to the ECHA C&L Inventory.

Methyl p-tolyl sulfide Use and Manufacturing

Manufacturing Info：

Benzene, 1-methyl-4-(methylthio)-: ACTIVE

Computed Properties

Molecular Weight:138.23
XLogP3:3.2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:138.05032149
Monoisotopic Mass:138.05032149
Topological Polar Surface Area:25.3
Heavy Atom Count:9
Complexity:72.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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(4-Methylthio)toluene

CAS No.: 623-13-2

Content: 99.00%

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