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1-(Methylthio)-3-nitrobenzene

1-(Methylthio)-3-nitrobenzene structure

CAS No:
2524-76-7
Formula:
C7H7NO2S
Chemical Name:
1-(Methylthio)-3-nitrobenzene
Synonyms:
Benzene,1-(methylthio)-3-nitro-;Sulfide,methyl m-nitrophenyl;1-(Methylthio)-3-nitrobenzene;Methyl m-nitrophenyl sulfide;m-Nitrothioanisole;m-Nitrophenyl methyl sulfide;Methyl 3-nitrophenyl sulfide;NSC 53644;1-(Methylsulfanyl)-3-nitrobenzene;3-Nitrothioanisole
Categories:
Organic Chemistry > Ethers and Derivatives

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1-(Methylthio)-3-nitrobenzene Basic Attributes

Molecular Weight：

169.2

Exact Mass：

169.20

EC Number：

219-761-7

NSC Number：

53644

DSSTox ID：

DTXSID30179899

HScode：

2930909090

Characteristics

PSA：

71.1

XLogP3：

2.63

Density：

1.3±0.1 g/cm3

Melting Point：

14.5 °C

Boiling Point：

133-134 °C @ Press: 4 Torr

Flash Point：

112.6±22.6 °C

Refractive Index：

1.602

Vapor Pressure：

0.0176mmHg at 25°C

Safety Information

Hazard category：

IRRITANT, STENCH

Marks：

Precautionary statement(s)：

P261, P264, P270, P272, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P272, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:169.20
XLogP3:2.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:169.01974964
Monoisotopic Mass:169.01974964
Topological Polar Surface Area:71.1
Heavy Atom Count:11
Complexity:146
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 1-(Methylthio)-3-nitrobenzene

Hangzhou Royalchem Co.,LTD Contact Supplier

CN
2 YRS

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3-Nitro thioanisole RC04947

Unit Price: $1 /KG EXW

CAS No.: 2524-76-7

Grade: Industrial Grade

Content: 99%

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Guide of 1-(Methylthio)-3-nitrobenzene

Basic Attributes
Characteristics
Safety Information
Computed Properties
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1-(Methylthio)-3-nitrobenzene

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