Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-

Modify Date: 2025-09-24 21:16:53

Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)- Structure
Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)- structure
Common Name Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-
CAS Number 13909-20-1 Molecular Weight 255.70100
Density 1.25g/cm3 Boiling Point N/A
Molecular Formula C11H14ClN3O2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 1-(2-chloroethyl)-3-(2,6-dimethylphenyl)-1-nitrosourea
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.25g/cm3
Molecular Formula C11H14ClN3O2
Molecular Weight 255.70100
Exact Mass 255.07700
PSA 61.77000
LogP 3.13050
Index of Refraction 1.568
InChIKey ZOHKEOXYIXHHCJ-UHFFFAOYSA-N
SMILES Cc1cccc(C)c1NC(=O)N(CCCl)N=O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YS5160000
CHEMICAL NAME :
Urea, 1-(2-chloroethyl)-1-nitroso-3-(2,6-xylyl)-
CAS REGISTRY NUMBER :
13909-20-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H14-Cl-N3-O2
MOLECULAR WEIGHT :
255.73
WISWESSER LINE NOTATION :
ONN2GVMR B1 F1

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)-1-nitroso-3-(2,6-xylyl)urea
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