N-(Chloro-2 ethyl)-N-nitrosocarbamyl-L-threonine [French]

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Names

[ CAS No. ]:
80687-08-7

[ Name ]:
N-(Chloro-2 ethyl)-N-nitrosocarbamyl-L-threonine [French]

Chemical & Physical Properties

[ Density]:
1.58g/cm3

[ Molecular Formula ]:
C7H12ClN3O5

[ Molecular Weight ]:
253.64000

[ Exact Mass ]:
253.04700

[ PSA ]:
119.30000

[ LogP ]:
0.14310

[ Index of Refraction ]:
1.581

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XO8620000
CHEMICAL NAME :
Threonine, N-((2-chloroethyl)nitrosocarbamoyl)-, L-
CAS REGISTRY NUMBER :
80687-08-7
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H12-Cl-N3-O5
MOLECULAR WEIGHT :
253.67

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
110 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 19,512,1984

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • benzyl (2S,3R)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]-3-hydroxybutanoate
  • L-Threonine

DownStream

  • Butanamide,2-[[[(2-chloroethyl)nitrosoamino]carbonyl]amino]-3-hydroxy-N-(4-methylphenyl)-,[R-(R*,S*)]- (9CI)

Related Compounds

  • rac-(1R,2S)-1-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-phenylcyclopropane-1-carboxylic acid
  • (3S,4S)-4-cyclopentylpyrrolidine-3-carboxylic acid
  • rac-(3R,4S)-4-(4-fluoro-2-methylphenyl)pyrrolidine-3-carboxylic acid
  • (R)-8-Oxa-2-azaspiro[4.5]decane-4-carboxylic acid
  • (2S)-4-Amino-1-ethoxybutan-2-ol
  • 5-Fluoro-2-propyl-2,3-dihydro-1H-isoindol-1-one
  • Ethanone, 1-[(2R,6S)-2,6-dimethyl-1-piperazinyl]-2-methoxy-, rel-
  • 2-Ethyl-6H,7H-[1,3]thiazolo[5,4-D]pyrimidine-7-thione
  • 3-Amino-3-[3-fluoro-5-(trifluoromethyl)phenyl]propanenitrile
  • (3S,4S)-1-benzyl-4-cyclohexylpyrrolidine-3-carboxylic acid
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