trans-1-(2-Chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitrosourea formate

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Names

[ CAS No. ]:
61367-11-1

[ Name ]:
trans-1-(2-Chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitrosourea formate

[Synonym ]:
trans-1-(2-Chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitrosourea formate
Urea,1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-,formate,(E)
(4-{[(2-chloroethyl)(nitroso)carbamoyl]amino}cyclohexyl)methyl formate

Chemical & Physical Properties

[ Density]:
1.39g/cm3

[ Molecular Formula ]:
C11H18ClN3O4

[ Molecular Weight ]:
291.73100

[ Exact Mass ]:
291.09900

[ PSA ]:
88.07000

[ LogP ]:
2.67680

[ Index of Refraction ]:
1.577

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YS4986300
CHEMICAL NAME :
Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nit roso-, formate, (E)-
CAS REGISTRY NUMBER :
61367-11-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H18-Cl-N3-O4
MOLECULAR WEIGHT :
291.77
WISWESSER LINE NOTATION :
L6TJ AMVNNO&2G D1OVH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD10 - Lethal Dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
22 mg/kg
TOXIC EFFECTS :
Tumorigenic - active as anti-cancer agent
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: 23,1095,1980

Synthetic Route

Precursor & DownStream

Precursor

  • trans-4-Aminocyclohexanemethanol
  • Formic Acid
  • 1-(2-chloroethyl)-3-[4-(hydroxymethyl)cyclohexyl]urea

DownStream


Related Compounds

  • 1-(ethoxymethyl)-5-{[(prop-2-en-1-yloxy)carbonyl]amino}-1H-1,2,3-triazole-4-carboxylic acid
  • 2-{N-[2-(diethylamino)ethyl]-2,2,2-trifluoroacetamido}acetic acid
  • tert-butyl N-(2-fluoro-5-methyl-4-nitrophenyl)carbamate
  • tert-butyl N-(5-fluoro-4-methyl-2-nitrophenyl)carbamate
  • tert-butyl N-(5-fluoro-3-methyl-2-nitrophenyl)carbamate
  • Methyl 3-{[(tert-butoxy)carbonyl]amino}-2-fluoropyridine-4-carboxylate
  • tert-butyl N-(6-fluoro-2-methyl-3-nitrophenyl)carbamate
  • (1S)-1-(5,6-dimethyl-1-benzofuran-2-yl)-2-methylpropan-1-amine
  • 4-acetyl-1,1-dioxo-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-3-carboxylic acid
  • 3-({1-[(Prop-2-en-1-yloxy)carbonyl]pyrrolidin-2-yl}formamido)propanoic acid
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