U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C10H9F3O2
Molecular Weight 218.1725
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of M-(TRIFLUOROMETHYL)HYDROCINNAMIC ACID

SMILES

OC(=O)CCC1=CC(=CC=C1)C(F)(F)F

InChI

InChIKey=YLTJJMIWCCJIHI-UHFFFAOYSA-N
InChI=1S/C10H9F3O2/c11-10(12,13)8-3-1-2-7(6-8)4-5-9(14)15/h1-3,6H,4-5H2,(H,14,15)

HIDE SMILES / InChI

Approval Year

Patents
Name Type Language
M-(TRIFLUOROMETHYL)HYDROCINNAMIC ACID
Systematic Name English
BENZENEPROPANOIC ACID, 3-(TRIFLUOROMETHYL)-
Systematic Name English
CINACALCET (M5)
Common Name English
3-TRIFLUOROMETHYLBENZENEPROPANOIC ACID
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID00380617
Created by admin on Sat Dec 16 11:15:05 GMT 2023 , Edited by admin on Sat Dec 16 11:15:05 GMT 2023
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PUBCHEM
2777683
Created by admin on Sat Dec 16 11:15:05 GMT 2023 , Edited by admin on Sat Dec 16 11:15:05 GMT 2023
PRIMARY
CAS
585-50-2
Created by admin on Sat Dec 16 11:15:05 GMT 2023 , Edited by admin on Sat Dec 16 11:15:05 GMT 2023
PRIMARY
FDA UNII
4U44XHH79H
Created by admin on Sat Dec 16 11:15:05 GMT 2023 , Edited by admin on Sat Dec 16 11:15:05 GMT 2023
PRIMARY