2-[(2-chlorophenyl)methyl]propanedinitrile

Modify Date: 2025-08-27 12:27:31

2-[(2-chlorophenyl)methyl]propanedinitrile structure	Common Name	2-[(2-chlorophenyl)methyl]propanedinitrile
	CAS Number	40915-55-7	Molecular Weight	190.62900
	Density	1.234g/cm3	Boiling Point	370.3ºC at 760 mmHg
	Molecular Formula	C₁₀H₇ClN₂	Melting Point	N/A
	MSDS	N/A	Flash Point	171.5ºC

Name	2-[(2-chlorophenyl)methyl]propanedinitrile
Synonym	More Synonyms

Density	1.234g/cm3
Boiling Point	370.3ºC at 760 mmHg
Molecular Formula	C₁₀H₇ClN₂
Molecular Weight	190.62900
Flash Point	171.5ºC
Exact Mass	190.03000
PSA	47.58000
LogP	2.54586
Index of Refraction	1.557
InChIKey	YETVIAIVJSRDFR-UHFFFAOYSA-N
SMILES	N#CC(C#N)Cc1ccccc1Cl

CHEMICAL IDENTIFICATION

RTECS NUMBER :: OO3660000

CHEMICAL NAME :: Malononitrile, o-chlorobenzyl-

CAS REGISTRY NUMBER :: 40915-55-7

LAST UPDATED :: 198509

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C10-H7-Cl-N2

MOLECULAR WEIGHT :: 190.64

WISWESSER LINE NOTATION :: NCYCN&1R BG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 78400 ug/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - other changes

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 25,111,1973

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: 39 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: PJPPAA Polish Journal of Pharmacology and Pharmacy. (ARS Polona, POB 1001, 00-068 Warsaw 1, Poland) V.25- 1973- Volume(issue)/page/year: 31,563,1979

HS Code	2926909090

2-Chlorobenzaldehyde

CAS#:89-98-5

Malononitrile

CAS#:109-77-3

~76%

2-[(2-chlorophe...

CAS#:40915-55-7

Literature: Wu, Jiashou; Jiang, Huajiang Synthetic Communications, 2011 , vol. 41, # 8 p. 1218 - 1226

CS gas

CAS#:2698-41-1

~85%

2-[(2-chlorophe...

CAS#:40915-55-7

Literature: Hosseini-Sarvari, Mona; Sharghi, Hashem; Etemad, Samane Helvetica Chimica Acta, 2008 , vol. 91, # 4 p. 715 - 724

Malononitrile

CAS#:109-77-3

2-[(2-chlorophe...

CAS#:40915-55-7

Literature: Wu, Zhong-Liu; Li, Zu-Yi Tetrahedron Asymmetry, 2003 , vol. 14, # 15 p. 2133 - 2142

Precursor 3
CAS#:89-98-5 2-Chlorobenzaldehyde CAS#:109-77-3 Malononitrile CAS#:2698-41-1 CS gas
DownStream 0

HS Code	2926909090
Summary	HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

o-Chlorobenzylomalonylonitryl [Polish]

Nitrylu o-chlorobenzylomalonowego [Polish]

orthochlorobenzyl-malononitrile

o-Chlorobenzylmalononitrile

Nitrylu o-chlorobenzylomalonowego

o-Chlorobenzylomalonylonitryl

MALONONITRILE,o-CHLOROBENZYL

(2-chlorobenzyl)malononitrile

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2-[(2-chlorophenyl)methyl]propanedinitrile

Names

Chemical & Physical Properties

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

Safety Information

Synthetic Route

Precursor & DownStream

Customs

Synonyms

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.