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2-(Methylthio)aniline

2-(Methylthio)aniline structure

CAS No:
2987-53-3
Formula:
C7H9NS
Chemical Name:
2-(Methylthio)aniline
Synonyms:
Benzenamine,2-(methylthio)-;Aniline,o-(methylthio)-;2-(Methylthio)benzenamine;o-Aminophenyl methyl sulfide;o-(Methylthio)aniline;2-(Methylmercapto)aniline;2-(Methylthio)aniline;2-Aminothioanisole;2-Aminophenyl methyl sulfide;o-(Methylmercapto)aniline;o-Aminothioanisole;Methyl o-aminophenyl sulfide;(2-(Methylthio)phenyl)amine;NSC 41588;NSC 62853;NSC 9425;2-(Methylsulfanyl)aniline;2-Methylsulfanylphenylamine
Categories:
Chemical Reagents > Organic Reagents

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Description

Clear pale yellow liquid

2-(Methylthio)aniline Basic Attributes

Molecular Weight：

139.22

Exact Mass：

139.22

BRN：

386211

EC Number：

221-055-9

NSC Number：

62853|41588

DSSTox ID：

DTXSID80183986

HScode：

29309090

Characteristics

PSA：

51.3

XLogP3：

1.20

Appearance：

White to light beige Powder and/or Chunks

Density：

1.115 g/cm³ @ Temp: 25 °C

Melting Point：

215 °C

Boiling Point：

234 °C

Flash Point：

>230 °F

Refractive Index：

1.612

Water Solubility：

soluble in water (less).

Vapor Pressure：

0.052mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN 2810 6.1/PG 3

wgk germany：

hazard class code：

safety instructions：

36/37

RTECS Number：

CY1138333

Marks：

Xn,Xi

Hazard note：

Irritant

Precautionary statement(s)：

P301 + P310

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (85.42%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 48 companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

2-(methylthio)aniline

Computed Properties

Molecular Weight:139.22
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:139.04557046
Monoisotopic Mass:139.04557046
Topological Polar Surface Area:51.3
Heavy Atom Count:9
Complexity:85
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Unit Price: $1 /KG EXW

CAS No.: 2987-53-3

Grade: Industrial Grade

Content: 99%

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