1-(3-(2-Chloroethyl)-3-nitrosoureido)cyclohexanecarboxylic acid ethyl ester

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Names

[ CAS No. ]:
13991-74-7

[ Name ]:
1-(3-(2-Chloroethyl)-3-nitrosoureido)cyclohexanecarboxylic acid ethyl ester

[Synonym ]:
ethyl 1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}cyclohexanecarboxylate
Cyclohexanecarboxylic acid,1-(3-(2-chloroethyl)-3-nitrosoureido)-,ethyl ester
1-(3-(2-Chloroethyl)-3-nitrosoureido)cyclohexanecarboxylic acid ethyl ester
1-({[(2-chloroethyl)nitrosoamino]carbonyl}amino)-cyclohexanecarboxylic acid,ethyl ester

Chemical & Physical Properties

[ Density]:
1.33g/cm3

[ Molecular Formula ]:
C12H20ClN3O4

[ Molecular Weight ]:
305.75800

[ Exact Mass ]:
305.11400

[ PSA ]:
88.07000

[ LogP ]:
2.57510

[ Index of Refraction ]:
1.559

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GU8419900
CHEMICAL NAME :
Cyclohexanecarboxylic acid, 1-(3-(2-chloroethyl)-3-nitrosoureido)-, ethyl ester
CAS REGISTRY NUMBER :
13991-74-7
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H20-Cl-N3-O4
MOLECULAR WEIGHT :
305.80
WISWESSER LINE NOTATION :
L6TJ AVO2 AMVNNO&2G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD10 - Lethal Dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 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

Safety Information

[ HS Code ]:
2924299090

Precursor & DownStream

Precursor

  • Cyclohexanecarboxylicacid, 1-amino-, ethyl ester

DownStream

Customs

[ HS Code ]: 2924299090

[ Summary ]:
2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Related Compounds

  • 5-phenyl-2,3-dihydro-1H-inden-1-one
  • Benzoic acid, 3,3'-(1,2-ethanediylbis(oxycarbonylimino-4,1-phenyleneimino(1-hydroxy-3-sulfo-6,2-naphthalenediyl)azo(2-(carboxymethoxy)-4,1-naphthalenediyl)azo-4,1-phenylenecarbonylimino))bis(6-hydroxy-, hexasodium salt
  • 1H-Pyrazole-3-carboxylic acid, 4,4'-(carbonylbis(imino(3-sulfo-4,1-phenylene)imino(6-chloro-1,3,5-triazine-4,2-diyl)imino(6-sulfo-3,1-phenylene)azo))bis(4,5-dihydro-5-oxo-1-(4-sulfophenyl)-, hexasodium salt
  • 2H-Naphtho(1,2-d)triazole-6,8-disulfonic acid, 2,2'-(2,3-oxadiaziridinediylbis((2-sulfo-4,1-phenylene)-2,1-ethenediyl(3-sulfo-4,1-phenylene)-3,2-oxadiaziridinediyl-4,1-phenylene))bis-, octasodium salt
  • Octasodium 3,3'-(1,3-phenylenebis(imino(6-chloro-1,3,5-triazine-4,2-diyl)imino(6-sulphonato-3,1-phenylene)azo))bis(5-amino-4-hydroxy-6-((4-sulphonatophenyl)azo)naphthalene-2,7-disulphonate)
  • mu-Conotoxin G IIIC (reduced)
  • Halicylindramide D
  • Myriceric acid A
  • Waglerin I (Trimeresurus wagleri venom reduced)
  • (2E,4E)-11-methoxy-3,7,11,13-tetramethyltetradeca-2,4-dienoic acid;[(1R,3R,5R,6R,8R,10R,11R,13R,15R,16R,18R,20R,21R,23R,25R,26R,28R,30R,31R,33R,35R,36S,37R,38S,39R,40S,41R,42S,43R,44S,45R,46S,47R,48S,49R)-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecaacetyloxy-10,15,20,25,30,35-hexakis(acetyloxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-5-yl]methyl acetate
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