4-[bis(2-chloroethyl)amino]benzamide

Names

[ CAS No. ]:
2045-42-3

[ Name ]:
4-[bis(2-chloroethyl)amino]benzamide

Chemical & Physical Properties

[ Density]:
1.293g/cm3

[ Boiling Point ]:
434.7ºC at 760 mmHg

[ Molecular Formula ]:
C11H14Cl2N2O

[ Molecular Weight ]:
261.14800

[ Flash Point ]:
216.7ºC

[ Exact Mass ]:
260.04800

[ PSA ]:
46.33000

[ LogP ]:
2.76980

[ Vapour Pressure ]:
9.3E-08mmHg at 25°C

[ Index of Refraction ]:
1.593

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CV2355000
CHEMICAL NAME :
Benzamide, 4-(bis(2-chloroethyl)amino)-
CAS REGISTRY NUMBER :
2045-42-3
BEILSTEIN REFERENCE NO. :
2810538
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C11-H14-Cl2-N2-O
MOLECULAR WEIGHT :
261.17
WISWESSER LINE NOTATION :
ZVR 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 :
313 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 8,167,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
279 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 8,167,1965

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4-[bis(2-chloroethyl)amino]benzonitrile

DownStream

Related Compounds

  • N-[4-(acridin-9-ylamino)butyl]-4-[bis(2-chloroethyl)amino]benzamide
  • 4-[bis(2-chloroethyl)amino]-N-(2-chloroethyl)benzamide
  • 4-[bis(2-chloroethyl)amino]-N,N-dimethyl-benzamide
  • 4-[bis(2-chloroethyl)amino]-N-[(4-chlorophenyl)methylideneamino]benzamide
  • 4-[bis(2-chloroethyl)amino]-N-[4-(quinolin-4-ylamino)phenyl]benzamide hydrochloride
  • [4-[bis(2-chloroethyl)amino]phenyl]methyl hexadecanoate
  • 1-methyl-4-nitro-5-[(2S)-oxiran-2-yl]-1H-pyrazole
  • 4-chloro-5-(2-isocyanatoethyl)-7H-pyrrolo[2,3-d]pyrimidine
  • O-[2-(4-fluoro-3-nitrophenyl)ethyl]hydroxylamine
  • 5-(2-Isocyanatopropan-2-yl)-4-methylpyrimidine
  • 1-Bromo-3-fluoro-5-(2-isocyanatopropan-2-yl)benzene
  • (4-fluoro-1H-indol-3-yl)methanesulfonamide
  • 4-[5-(Trifluoromethyl)pyridin-2-yl]oxane-2,6-dione
  • 2-Fluoro-4-(2-isocyanatopropan-2-yl)-1-nitrobenzene
  • 2-[(Thiolan-3-yl)methyl]oxirane
  • 3-Oxo-1-{pyrazolo[1,5-a]pyridin-3-yl}cyclobutane-1-carboxylic acid
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