Benzonitrile, 4-(bis(2-chloromethyl)amino)-2-methyl-

Modify Date: 2025-12-03 09:48:22

Benzonitrile, 4-(bis(2-chloromethyl)amino)-2-methyl- Structure
Benzonitrile, 4-(bis(2-chloromethyl)amino)-2-methyl- structure
Common Name Benzonitrile, 4-(bis(2-chloromethyl)amino)-2-methyl-
CAS Number 73940-94-0 Molecular Weight 257.15900
Density 1.21g/cm3 Boiling Point 450.3ºC at 760 mmHg
Molecular Formula C12H14Cl2N2 Melting Point N/A
MSDS N/A Flash Point 226.2ºC

 Names

Name 4-[bis(2-chloroethyl)amino]-2-methylbenzonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.21g/cm3
Boiling Point 450.3ºC at 760 mmHg
Molecular Formula C12H14Cl2N2
Molecular Weight 257.15900
Flash Point 226.2ºC
Exact Mass 256.05300
PSA 27.03000
LogP 3.15068
Index of Refraction 1.557
InChIKey AFENMDJXRAINGX-UHFFFAOYSA-N
SMILES Cc1cc(N(CCCl)CCCl)ccc1C#N

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XV0900000
CHEMICAL NAME :
o-Tolunitrile, 4-(bis(2-chloroethyl)amino)-
CAS REGISTRY NUMBER :
73940-94-0
LAST UPDATED :
199707
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H14-Cl2-N2
MOLECULAR WEIGHT :
257.18
WISWESSER LINE NOTATION :
NCR B1 DN2G2G

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 :
32 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03490

 Synonyms

Benzonitrile,4-(bis(2-chloromethyl)amino)-2-methyl
o-Tolunitrile,4-(bis(2-chloroethyl)amino)
4-[Bis-(2-chlor-ethyl)-amino]-o-tolunitril
4-[Bis(2-chloroethyl)amino]-o-tolunitrile
Benzonitrile,4-(bis(2-chloroethyl)amino)-2-methyl
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