Benzoic acid,2-[bis(2-chloroethyl)amino]-

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Names

[ CAS No. ]:
3085-99-2

[ Name ]:
Benzoic acid,2-[bis(2-chloroethyl)amino]-

Chemical & Physical Properties

[ Density]:
1.339g/cm3

[ Boiling Point ]:
403.2ºC at 760mmHg

[ Molecular Formula ]:
C11H13Cl2NO2

[ Molecular Weight ]:
262.13200

[ Flash Point ]:
197.6ºC

[ Exact Mass ]:
261.03200

[ PSA ]:
40.54000

[ LogP ]:
2.66880

[ Index of Refraction ]:
1.594

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CB2557500
CHEMICAL NAME :
Anthranilic acid, N,N-bis(2-chloroethyl)-
CAS REGISTRY NUMBER :
3085-99-2
BEILSTEIN REFERENCE NO. :
2809059
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C11-H13-Cl2-N-O2
MOLECULAR WEIGHT :
262.15
WISWESSER LINE NOTATION :
QVR BN2G2G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Unreported
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
320 mg/kg
TOXIC EFFECTS :
Tumorigenic - active as anti-cancer agent

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Human Lymphocyte
DOSE/DURATION :
1200 nmol/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 346,129,1995

Safety Information

[ HS Code ]:
2922499990

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • N,N-bis-(2-chloro-ethyl)-anthranilic acid methyl ester
  • 1-(2-hydroxy-ethyl)-2,3-dihydro-1H-benz[e][1,4]oxazepin-5-one
  • N,N-bis-(2-hydroxy-ethyl)-anthranilic acid methyl ester
  • Methyl 2-aminobenzoate

DownStream

Customs

[ HS Code ]: 2922499990

[ Summary ]:
HS:2922499990 other amino-acids, other than those containing more than one kind of oxygen function, and their esters; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • 2-[bis(2-chloroethyl)amino]-3-methylbenzoic acid
  • 2-[Bis(2-chloroethyl)amino]-p-toluic acid
  • BENZOIC ACID, 2-((4-(BIS(2-CHLOROETHYL)AMINO)PHENYL)AZO)-
  • Benzoic acid, 2-[[[4-[bis (2-chloroethyl)amino]phenyl]methylene]amino]-
  • Benzoic acid,2-(acetyloxy)-4-[bis(2-chloroethyl)amino]-
  • Benzoic acid,2-[[[(2-chloroethyl)amino]carbonyl]amino]-
  • 1-(3-methoxyphenyl)-5-methyl-N-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide
  • N-(3,4-dichlorophenyl)-1-(3-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
  • ethyl 3-({[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]carbonyl}amino)benzoate
  • 5-methyl-1-(4-methylphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide
  • 1-(2-ethoxyphenyl)-5-methyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide
  • 3-((1-(4-chlorophenyl)-1H-tetrazol-5-yl)thio)-N-(thiazol-2-yl)propanamide
  • N-(4-methoxyphenyl)-3-{[1-(3-methylphenyl)-1H-tetrazol-5-yl]sulfanyl}propanamide
  • N-cyclopentyl-3-{[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}propanamide
  • 3-{[1-(3-methylphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(1,3-thiazol-2-yl)propanamide
  • 3-((1-(4-methoxyphenyl)-1H-tetrazol-5-yl)thio)-N-(thiazol-2-yl)propanamide