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

Modify Date: 2025-09-27 17:48:38

Benzoic acid,2-[bis(2-chloroethyl)amino]- Structure
Benzoic acid,2-[bis(2-chloroethyl)amino]- structure
 Common Name Benzoic acid,2-[bis(2-chloroethyl)amino]-
CAS Number 3085-99-2 Molecular Weight 262.13200
Density 1.339g/cm3 Boiling Point 403.2ºC at 760mmHg
Molecular Formula C11H13Cl2NO2 Melting Point N/A
MSDS N/A Flash Point 197.6ºC

 Names

Name 2-[bis(2-chloroethyl)amino]benzoic acid

 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
InChIKey UXUKWLCXNDMFIX-UHFFFAOYSA-N
SMILES O=C(O)c1ccccc1N(CCCl)CCCl

 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

N,N-bis-(2-chloro-ethyl)-anthranilic acid methyl ester structure

N,N-bis-(2-chlo...

CAS#:3086-00-8

~%

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

Benzoic acid,2-...

CAS#:3085-99-2

Literature: Everett et al. Journal of the Chemical Society, 1953 , p. 2386,2387
1-(2-hydroxy-ethyl)-2,3-dihydro-1H-benz[e][1,4]oxazepin-5-one structure

1-(2-hydroxy-et...

CAS#:854163-11-4

~%

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

Benzoic acid,2-...

CAS#:3085-99-2

Literature: Everett et al. Journal of the Chemical Society, 1953 , p. 2386,2387
N,N-bis-(2-hydroxy-ethyl)-anthranilic acid methyl ester structure

N,N-bis-(2-hydr...

CAS#:802828-40-6

~%

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

Benzoic acid,2-...

CAS#:3085-99-2

Literature: Everett et al. Journal of the Chemical Society, 1953 , p. 2386,2387
Methyl 2-aminobenzoate structure

Methyl 2-aminob...

CAS#:134-20-3

~%

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

Benzoic acid,2-...

CAS#:3085-99-2

Literature: Everett et al. Journal of the Chemical Society, 1953 , p. 2386,2387

 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%
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Chemsrc provides CAS#:3085-99-2 MSDS, density, melting point, boiling point, structure, etc. Its name is Benzoic acid,2-[bis(2-chloroethyl)amino]->> amp version: Benzoic acid,2-[bis(2-chloroethyl)amino]-

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