3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid

Modify Date: 2024-01-09 13:23:56

3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid Structure
3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid structure
 Common Name 3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid
CAS Number 6746-11-8 Molecular Weight 290.18600
Density 1.277g/cm3 Boiling Point 447ºC at 760 mmHg
Molecular Formula C13H17Cl2NO2 Melting Point N/A
MSDS N/A Flash Point 224.1ºC

 Names

Name p-N,N-Di(2-chloroethyl)aminophenylpropionic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.277g/cm3
Boiling Point 447ºC at 760 mmHg
Molecular Formula C13H17Cl2NO2
Molecular Weight 290.18600
Flash Point 224.1ºC
Exact Mass 289.06400
PSA 40.54000
LogP 2.98780
Index of Refraction 1.576

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MW5095000
CHEMICAL NAME :
Hydrocinnamic acid, p-(bis(2-chloroethyl)amino)-
CAS REGISTRY NUMBER :
6746-11-8
BEILSTEIN REFERENCE NO. :
3059603
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C13-H17-Cl2-N-O2
MOLECULAR WEIGHT :
290.21
WISWESSER LINE NOTATION :
QV2R DN2G2G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>20 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TEST SYSTEM :
Insect - Drosophila melanogaster
DOSE/DURATION :
10 mmol/L
REFERENCE :
ANYAA9 Annals of the New York Academy of Sciences. (New York Academy of Sciences, 2 E. 63rd St., New York, NY 10021) V.1- 1877- Volume(issue)/page/year: 160,228,1969

 Safety Information

HS Code 2922499990

 Synthetic Route

ethyl 3-[4-(N,N-bis(2-chloroethyl)amino)phenyl]propanoate structure

ethyl 3-[4-(N,N...

CAS#:64977-23-7

~100%

3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid Structure

3-[4-[bis(2-chl...

CAS#:6746-11-8

Literature: Khunnawutmanotham, Nisachon; Chimnoi, Nitirat; Champathong, Wattanachai; Lerdsirisuk, Pradit; Khotmor, Theeraphon; Techasakul, Supanna Journal of Chemical Research, 2012 , vol. 36, # 6 p. 374 - 378
ethyl 3-[4-(N,N-bis(2-chloroethyl)amino)phenyl]prop-2-enoate structure

ethyl 3-[4-(N,N...

CAS#:1397265-89-2

~%

3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid Structure

3-[4-[bis(2-chl...

CAS#:6746-11-8

Literature: Khunnawutmanotham, Nisachon; Chimnoi, Nitirat; Champathong, Wattanachai; Lerdsirisuk, Pradit; Khotmor, Theeraphon; Techasakul, Supanna Journal of Chemical Research, 2012 , vol. 36, # 6 p. 374 - 378
2,2'-(Phenylimino)diethanol structure

2,2'-(Phenylimi...

CAS#:120-07-0

~%

3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid Structure

3-[4-[bis(2-chl...

CAS#:6746-11-8

Literature: Khunnawutmanotham, Nisachon; Chimnoi, Nitirat; Champathong, Wattanachai; Lerdsirisuk, Pradit; Khotmor, Theeraphon; Techasakul, Supanna Journal of Chemical Research, 2012 , vol. 36, # 6 p. 374 - 378
Benzaldehyde,4-[bis(2-chloroethyl)amino]- structure

Benzaldehyde,4-...

CAS#:1208-03-3

~%

3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid Structure

3-[4-[bis(2-chl...

CAS#:6746-11-8

Literature: Khunnawutmanotham, Nisachon; Chimnoi, Nitirat; Champathong, Wattanachai; Lerdsirisuk, Pradit; Khotmor, Theeraphon; Techasakul, Supanna Journal of Chemical Research, 2012 , vol. 36, # 6 p. 374 - 378
Ethyl 3-(4-aminophenyl)propanoate structure

Ethyl 3-(4-amin...

CAS#:7116-44-1

~%

3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid Structure

3-[4-[bis(2-chl...

CAS#:6746-11-8

Literature: Everett et al. Journal of the Chemical Society, 1953 , p. 2386,2387
3-{4-[bis-(2-hydroxy-ethyl)-amino]-phenyl}-propionic acid ethyl ester structure

3-{4-[bis-(2-hy...

CAS#:124673-89-8

~%

3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid Structure

3-[4-[bis(2-chl...

CAS#:6746-11-8

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%

 Synonyms

3-[4-[N,N-Bis(2-chloroethyl)amino]phenyl]propionic acid
3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid
3-{4-[Bis-(2-chlor-aethyl)-amino]-phenyl}-propionsaeure
p-[bis(2-chloroethyl)amino]-b-phenylpropionic acid
3-[(4-N,N-bis(2-chloroethyl)amino)phenyl]propanoic acid
p-[Bis(2-chloroethyl)amino]hydrocinnamic acid
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Chemsrc provides CAS#:6746-11-8 MSDS, density, melting point, boiling point, structure, etc. Its name is 3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid>> amp version: 3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid

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