2,5-Cyclohexadien-1-one,4-[[4-[bis(2-chloroethyl)amino]phenyl]imino]-

Modify Date: 2025-08-21 00:15:26

2,5-Cyclohexadien-1-one,4-[[4-[bis(2-chloroethyl)amino]phenyl]imino]- structure	Common Name	2,5-Cyclohexadien-1-one,4-[[4-[bis(2-chloroethyl)amino]phenyl]imino]-
	CAS Number	64048-64-2	Molecular Weight	323.21700
	Density	1.22g/cm3	Boiling Point	463ºC at 760 mmHg
	Molecular Formula	C₁₆H₁₆Cl₂N₂O	Melting Point	N/A
	MSDS	N/A	Flash Point	233.8ºC

Name	4-[4-[bis(2-chloroethyl)amino]phenyl]iminocyclohexa-2,5-dien-1-one

Density	1.22g/cm3
Boiling Point	463ºC at 760 mmHg
Molecular Formula	C₁₆H₁₆Cl₂N₂O
Molecular Weight	323.21700
Flash Point	233.8ºC
Exact Mass	322.06400
PSA	32.67000
LogP	3.73820
Index of Refraction	1.581
InChIKey	LUKFYERPDCANBJ-UHFFFAOYSA-N
SMILES	O=C1C=CC(=Nc2ccc(N(CCCl)CCCl)cc2)C=C1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DK5250000

CHEMICAL NAME :: p-Benzoquinoneimine, N-(p-(di-2''-chloroethylamino)phenyl)-

CAS REGISTRY NUMBER :: 64048-64-2

LAST UPDATED :: 199012

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C16-H16-Cl2-N2-O

MOLECULAR WEIGHT :: 323.24

WISWESSER LINE NOTATION :: L6V DYJ DUNR DN2G2G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 107 mg/kg

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

REFERENCE :: BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 13,969,1964

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Dayang Chem (Hangzhou) Co., Ltd.
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Product Name: 2,5-Cyclohexadien-1-one,4-[[4-[bis(2-chloroethyl)amino]phenyl]imino]-
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Purity: 98.0%
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