3,5-bis[(2-chloroethyl-nitroso-carbamoyl)amino]benzoic acid

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Names

[ CAS No. ]:
13907-61-4

[ Name ]:
3,5-bis[(2-chloroethyl-nitroso-carbamoyl)amino]benzoic acid

Chemical & Physical Properties

[ Density]:
1.64g/cm3

[ Molecular Formula ]:
C13H14Cl2N6O6

[ Molecular Weight ]:
421.19300

[ Exact Mass ]:
420.03500

[ PSA ]:
160.84000

[ LogP ]:
3.03900

[ Index of Refraction ]:
1.658

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DG4429500
CHEMICAL NAME :
Benzoic acid, 3,5-bis(3-(2-chloroethyl)-3-nitrosoureido)-
CAS REGISTRY NUMBER :
13907-61-4
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H14-Cl2-N6-O6
MOLECULAR WEIGHT :
421.23
WISWESSER LINE NOTATION :
ONN2GVMR CVQ EMVNNO&&2G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD10 - Lethal Dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
370 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
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: 9,892,1966

Safety Information

[ HS Code ]:
2924299090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 3,5-Diaminobenzoic acid
  • Benzoicacid, 3,5-bis[[[(2-chloroethyl)amino]carbonyl]amino]-

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

  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 1-(4,6-Dichloropyridin-3-yl)prop-2-en-1-ol
  • 1-[5-Chloro-6-(propan-2-yloxy)pyridin-3-yl]-2,2,2-trifluoroethan-1-ol
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine