1,2-Bis(2-cyanoethylthio)ethane

Modify Date: 2024-01-08 18:34:14

1,2-Bis(2-cyanoethylthio)ethane Structure
1,2-Bis(2-cyanoethylthio)ethane structure
 Common Name 1,2-Bis(2-cyanoethylthio)ethane
CAS Number 86180-54-3 Molecular Weight 200.324
Density 1.1±0.1 g/cm3 Boiling Point 424.3±35.0 °C at 760 mmHg
Molecular Formula C8H12N2S2 Melting Point 93ºC
MSDS N/A Flash Point 210.4±25.9 °C

 Names

Name 3,3'-(Ethylenedithio)dipropionitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 424.3±35.0 °C at 760 mmHg
Melting Point 93ºC
Molecular Formula C8H12N2S2
Molecular Weight 200.324
Flash Point 210.4±25.9 °C
Exact Mass 200.044189
PSA 98.18000
LogP 0.71
Vapour Pressure 0.0±1.0 mmHg at 25°C
Index of Refraction 1.539

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TZ4685000
CHEMICAL NAME :
Propanenitrile, 3,3'-(1,2-ethanediylbis(thio))bis-
CAS REGISTRY NUMBER :
86180-54-3
BEILSTEIN REFERENCE NO. :
1760850
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H12-N2-S2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. (Washington, DC) Volume(issue)/page/year: 5,32,1953

 Safety Information

Hazard Codes Xi
HS Code 2930909090

 Synthetic Route

1,2-Ethanedithiol structure

1,2-Ethanedithiol

CAS#:540-63-6

Acrylonitrile structure

Acrylonitrile

CAS#:107-13-1

~91%

1,2-Bis(2-cyanoethylthio)ethane Structure

1,2-Bis(2-cyano...

CAS#:86180-54-3

Literature: Chahdoura, Faouzi; Pradel, Christian; Gomez, Montserrat Advanced Synthesis and Catalysis, 2013 , vol. 355, # 18 p. 3648 - 3660
3-Bromopropionitrile structure

3-Bromopropionitrile

CAS#:2417-90-5

1,2-Ethanedithiol structure

1,2-Ethanedithiol

CAS#:540-63-6

~87%

1,2-Bis(2-cyanoethylthio)ethane Structure

1,2-Bis(2-cyano...

CAS#:86180-54-3

Literature: Bridger, Gary J.; Skerlj, Renato T.; Padmanabhan, Sreenivasan; Martellucci, Stephen A.; Henson, Geoffrey W.; Struyf, Sofie; Witvrouw, Myriam; Schols, Dominique; De Clercq, Erik Journal of Medicinal Chemistry, 1999 , vol. 42, # 19 p. 3971 - 3981
Mustard gas structure

Mustard gas

CAS#:505-60-2

POTASSIUM CYANIDE structure

POTASSIUM CYANIDE

CAS#:151-50-8

~%

1,2-Bis(2-cyanoethylthio)ethane Structure

1,2-Bis(2-cyano...

CAS#:86180-54-3

Literature: Journal of the Chemical Society, , p. 1808 Journal of the Chemical Society, , vol. 117, p. 299
Ethanol structure

Ethanol

CAS#:64-17-5

Mustard gas structure

Mustard gas

CAS#:505-60-2

POTASSIUM CYANIDE structure

POTASSIUM CYANIDE

CAS#:151-50-8

~%

1,2-Bis(2-cyanoethylthio)ethane Structure

1,2-Bis(2-cyano...

CAS#:86180-54-3

Literature: Journal of the Chemical Society, , p. 1808 Journal of the Chemical Society, , vol. 117, p. 299 Chemische Berichte, , vol. 53, p. 1008

 Customs

HS Code 2930909090
Summary 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

3,3'-(Ethane-1,2-diyldisulfanediyl)dipropanenitrile
3-[2-(2-cyanoethylsulfanyl)ethylsulfanyl]propanenitrile
propanenitrile, 3,3'-[1,2-ethanediylbis(thio)]bis-
3,3'-(1,2-Ethanediyldisulfanediyl)dipropanenitrile
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