2-(3-chloro-4-piperidin-1-ylphenyl)acetic acid

Modify Date: 2024-02-04 21:27:34

2-(3-chloro-4-piperidin-1-ylphenyl)acetic acid Structure
2-(3-chloro-4-piperidin-1-ylphenyl)acetic acid structure
Common Name 2-(3-chloro-4-piperidin-1-ylphenyl)acetic acid
CAS Number 26586-30-1 Molecular Weight 253.72500
Density 1.261g/cm3 Boiling Point 427.8ºC at 760mmHg
Molecular Formula C13H16ClNO2 Melting Point N/A
MSDS N/A Flash Point 212.5ºC

 Names

Name 2-(3-chloro-4-piperidin-1-ylphenyl)acetic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.261g/cm3
Boiling Point 427.8ºC at 760mmHg
Molecular Formula C13H16ClNO2
Molecular Weight 253.72500
Flash Point 212.5ºC
Exact Mass 253.08700
PSA 40.54000
LogP 3.02240
Vapour Pressure 4.43E-08mmHg at 25°C
Index of Refraction 1.581

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AG1190000
CHEMICAL NAME :
Acetic acid, (3-chloro-4-piperidinophenyl)-
CAS REGISTRY NUMBER :
26586-30-1
BEILSTEIN REFERENCE NO. :
1252232
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H16-Cl-N-O2
MOLECULAR WEIGHT :
253.75
WISWESSER LINE NOTATION :
T6NTJ AR BG D1VQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
800 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: 22,1460,1979

 Synonyms

ACETIC ACID,(3-CHLORO-4-PIPERIDINOPHENYL)
(3-Chloro-4-piperidinophenyl)acetic acid
3-Chlor-4-piperidino-phenylessigsaeure
(3-chloro-4-piperidin-1-yl-phenyl)-acetic acid