Benzonitrile, 2-(chloroacetyl)- (9CI)

Modify Date: 2025-09-21 15:23:28

Benzonitrile, 2-(chloroacetyl)- (9CI) structure	Common Name	Benzonitrile, 2-(chloroacetyl)- (9CI)
	CAS Number	1008-15-7	Molecular Weight	179.60300
	Density	1.26g/cm3	Boiling Point	332.1ºC at 760mmHg
	Molecular Formula	C₉H₆ClNO	Melting Point	N/A
	MSDS	N/A	Flash Point	154.6ºC

Name	2-(2-chloroacetyl)benzonitrile
Synonym	More Synonyms

Density	1.26g/cm3
Boiling Point	332.1ºC at 760mmHg
Molecular Formula	C₉H₆ClNO
Molecular Weight	179.60300
Flash Point	154.6ºC
Exact Mass	179.01400
PSA	40.86000
LogP	1.97978
Vapour Pressure	0.000149mmHg at 25°C
Index of Refraction	1.556
InChIKey	QLWBWNBFUCQEJM-UHFFFAOYSA-N
SMILES	N#Cc1ccccc1C(=O)CCl

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DI2975000

CHEMICAL NAME :: Benzonitrile, o-(chloroacetyl)-

CAS REGISTRY NUMBER :: 1008-15-7

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C9-H6-Cl-N-O

MOLECULAR WEIGHT :: 179.61

WISWESSER LINE NOTATION :: NCR BV1G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 10 mg/kg

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

REFERENCE :: NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689

HS Code	2926909090

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%

USAF uctl-668

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Product Name: Benzonitrile, 2-(chloroacetyl)- (9CI)
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