1-(2-chloroethyl)-1-nitroso-3-[(3S,4S,5R,6S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea

Modify Date: 2025-08-26 20:42:06

1-(2-chloroethyl)-1-nitroso-3-[(3S,4S,5R,6S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea Structure
1-(2-chloroethyl)-1-nitroso-3-[(3S,4S,5R,6S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea structure
 Common Name 1-(2-chloroethyl)-1-nitroso-3-[(3S,4S,5R,6S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea
CAS Number 102492-21-7 Molecular Weight 313.69200
Density N/A Boiling Point N/A
Molecular Formula C9H16ClN3O7 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 1-(2-chloroethyl)-1-nitroso-3-[(3S,4S,5R,6S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C9H16ClN3O7
Molecular Weight 313.69200
Exact Mass 313.06800
PSA 151.92000
InChIKey MYBLAOJMRYYKMS-CGRSDTJUSA-N
SMILES O=NN(CCCl)C(=O)NC1C(O)OC(CO)C(O)C1O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YS4905150
CHEMICAL NAME :
Urea, 1-(2-chloroethyl)-3-(2-deoxy-L-mannopyranos-2-yl)-1-n itroso-
CAS REGISTRY NUMBER :
102492-21-7
LAST UPDATED :
198609
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H16-Cl-N3-O7
MOLECULAR WEIGHT :
313.73
WISWESSER LINE NOTATION :
T6OTJ BQ CMVNNO&2G DQ EQ F1Q

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD10 - Lethal Dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
37 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

 Synonyms

1-(2-Chloroethyl)-3-(2-deoxy-L-mannopyranos-2-yl)-1-nitrosourea
Urea,1-(2-chloroethyl)-3-(2-deoxy-L-mannopyranos-2-yl)-1-nitroso
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Chemsrc provides CAS#:102492-21-7 MSDS, density, melting point, boiling point, structure, etc. Its name is 1-(2-chloroethyl)-1-nitroso-3-[(3S,4S,5R,6S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea>> amp version: 1-(2-chloroethyl)-1-nitroso-3-[(3S,4S,5R,6S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea

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