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1,2-BIS(2-CYANOETHYLTHIO)ETHANE

1,2-BIS(2-CYANOETHYLTHIO)ETHANE structure

CAS No:
86180-54-3
Formula:
C8H12N2S2
Chemical Name:
1,2-BIS(2-CYANOETHYLTHIO)ETHANE
Synonyms:
3,3’-(ethylenedithio)di-propionitril;1,2-BIS(2-CYANOETHYLTHIO)ETHANE;3,3'-(ETHYLENEDITHIO)DIPROPIONITRILE;4,7-DITHIADECANEDINITRILE;3-[2-(2-Cyanoethylsulfanyl)ethylsulfanyl]propanenitrile;Brn 1760850;Propanenitrile, 3,3'-(1,2-ethanediylbis(thio))bis-;Propionitrile, 3,3'-(ethylenedithio)di-

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1,2-BIS(2-CYANOETHYLTHIO)ETHANE Basic Attributes

Molecular Weight：

200.32

Exact Mass：

200.044189

NSC Number：

215744

DSSTox ID：

DTXSID00235436

HScode：

2930909090

Characteristics

PSA：

98.2

XLogP3：

0.71

Density：

1.1±0.1 g/cm3

Melting Point：

93 °C

Boiling Point：

424.3±35.0 °C at 760 mmHg

Flash Point：

210.4±25.9 °C

Refractive Index：

1.539

Safety Information

RTECS Number：

TZ4685000

Precautionary statement(s)：

P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:200.3
XLogP3:0.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:200.04419074
Monoisotopic Mass:200.04419074
Topological Polar Surface Area:98.2
Heavy Atom Count:12
Complexity:164
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,2-BIS(2-CYANOETHYLTHIO)ETHANE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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