Fumaronitrile, dichloro-

Modify Date: 2025-08-21 15:14:08

Fumaronitrile, dichloro- Structure
Fumaronitrile, dichloro- structure
Common Name Fumaronitrile, dichloro-
CAS Number 6613-49-6 Molecular Weight 146.96200
Density 1.51g/cm3 Boiling Point 160.4ºC at 760 mmHg
Molecular Formula C4Cl2N2 Melting Point N/A
MSDS N/A Flash Point 50.6ºC

 Names

Name (E)-2,3-dichlorobut-2-enedinitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.51g/cm3
Boiling Point 160.4ºC at 760 mmHg
Molecular Formula C4Cl2N2
Molecular Weight 146.96200
Flash Point 50.6ºC
Exact Mass 145.94400
PSA 47.58000
LogP 1.72276
Index of Refraction 1.525
InChIKey UAIXJNRQLIOTOZ-ONEGZZNKSA-N
SMILES N#CC(Cl)=C(Cl)C#N

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EM5221532
CHEMICAL NAME :
2-Butenedinitrile, 2,3-dichloro-, (E)-
CAS REGISTRY NUMBER :
6613-49-6
LAST UPDATED :
199806
DATA ITEMS CITED :
2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
5010 ug/kg
TOXIC EFFECTS :
Gastrointestinal - other changes Liver - other changes Nutritional and Gross Metabolic - weight loss or decreased weight gain
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0545563

 Synthetic Route

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Detail
Literature: IHARA CHEMICAL INDUSTRY CO., LTD. Patent: US2012/46473 A1, 2012 ; Location in patent: Page/Page column 6 ;

~%

Detail
Literature: IHARA CHEMICAL INDUSTRY CO., LTD. Patent: US2012/46473 A1, 2012 ; Location in patent: Page/Page column 6-7 ;

~%

Fumaronitrile, dichloro- Structure

Fumaronitrile, ...

CAS#:6613-49-6

Literature: Eldred; Young Journal of the American Chemical Society, 1953 , vol. 75, p. 4338 Full Text View citing articles Show Details du Pont de Nemours and Co. Patent: US2443494 , 1944 ; Full Text Show Details Mommaerts Bulletin de la Classe des Sciences, Academie Royale de Belgique, 1941 , vol. <5>27, p. 592,595,596 Chem.Abstr., 1944 , p. 3621 Full Text Show Details Mommaerts Bulletin des Societes Chimiques Belges, 1943 , vol. 52, p. 64,70,76 Bulletin de la Classe des Sciences, Academie Royale de Belgique, 1941 , vol. <5>27, p. 581,588,595

~%

Fumaronitrile, dichloro- Structure

Fumaronitrile, ...

CAS#:6613-49-6

Literature: Eldred; Young Journal of the American Chemical Society, 1953 , vol. 75, p. 4338 Full Text View citing articles Show Details du Pont de Nemours and Co. Patent: US2443494 , 1944 ; Full Text Show Details Mommaerts Bulletin de la Classe des Sciences, Academie Royale de Belgique, 1941 , vol. <5>27, p. 592,595,596 Chem.Abstr., 1944 , p. 3621 Full Text Show Details Mommaerts Bulletin des Societes Chimiques Belges, 1943 , vol. 52, p. 64,70,76 Bulletin de la Classe des Sciences, Academie Royale de Belgique, 1941 , vol. <5>27, p. 581,588,595

~%

Fumaronitrile, dichloro- Structure

Fumaronitrile, ...

CAS#:6613-49-6

Literature: Eldred; Young Journal of the American Chemical Society, 1953 , vol. 75, p. 4338 Full Text View citing articles Show Details du Pont de Nemours and Co. Patent: US2443494 , 1944 ; Full Text Show Details Mommaerts Bulletin de la Classe des Sciences, Academie Royale de Belgique, 1941 , vol. <5>27, p. 592,595,596 Chem.Abstr., 1944 , p. 3621 Full Text Show Details Mommaerts Bulletin des Societes Chimiques Belges, 1943 , vol. 52, p. 64,70,76 Bulletin de la Classe des Sciences, Academie Royale de Belgique, 1941 , vol. <5>27, p. 581,588,595

~%

Detail
Literature: Lewis; Mayo Journal of the American Chemical Society, 1948 , vol. 70, p. 1533,1534 Full Text Show Details Mommaerts Bulletin de la Classe des Sciences, Academie Royale de Belgique, 1941 , vol. <5>27, p. 592,595,596 Chem.Abstr., 1944 , p. 3621 Full Text Show Details Mommaerts Bulletin des Societes Chimiques Belges, 1943 , vol. 52, p. 64,70,76 Bulletin de la Classe des Sciences, Academie Royale de Belgique, 1941 , vol. <5>27, p. 581,588,595

 Synonyms

1,2-dicyano-1,2-dichloroethylene
(E)-2,3-Dichloro-2-butenedinitrile
Fumaronitrile,dichloro-(7CI,8CI)
dichlorofumaronitrile
dichlorofumaric acid dinitrile
Fumaronitrile,dichloro
2-Butenedinitrile,2,3-dichloro-,(E)
Dichlorfumarsaeure-dinitril
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