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4-Nitrophenyl phenyl sulfide

4-Nitrophenyl phenyl sulfide structure

CAS No:
952-97-6
Formula:
C12H9NO2S
Chemical Name:
4-Nitrophenyl phenyl sulfide
Synonyms:
Benzene,1-nitro-4-(phenylthio)-;Sulfide,p-nitrophenyl phenyl;1-Nitro-4-(phenylthio)benzene;p-Nitrodiphenyl sulfide;p-Nitrophenyl phenyl sulfide;4-Nitrodiphenyl sulfide;4-Nitrophenyl phenyl sulfide;Phenyl p-nitrophenyl sulfide;Phenyl 4-nitrophenyl sulfide;4-(Phenylthio)nitrobenzene;4-Nitro-1-(phenylthio)benzene;NSC 87341;(4-Nitrophenyl)phenylsulphide;(4-Nitrophenyl)(phenyl)sulfane;1-Nitro-4-phenylsulfanyl-benzene;1-Nitro-4-phenylsulfanylbenzene
Categories:
Chemical Reagents > Organic Reagents

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Description

yellow crystalline powder

4-Nitrophenyl phenyl sulfide Basic Attributes

Molecular Weight：

231.27

Exact Mass：

231.27

EC Number：

213-462-5

NSC Number：

87341

DSSTox ID：

DTXSID50241784

HScode：

29309090

Characteristics

PSA：

71.12000

XLogP3：

4.26920

Appearance：

yellow crystalline powder

Density：

1.31g/cm3

Melting Point：

56 °C

Boiling Point：

288.2 °C @ Press: 100 Torr

Flash Point：

193.8ºC

Refractive Index：

1.665

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

RTECS Number：

WQ5620000

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

4-nitrodiphenyl thioether

Computed Properties

Molecular Weight:231.27
XLogP3:4.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:231.03539970
Monoisotopic Mass:231.03539970
Topological Polar Surface Area:71.1
Heavy Atom Count:16
Complexity:228
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Nitrophenyl phenyl sulfide

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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4-Nitrophenyl phenyl sulfide

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