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Details

Stereochemistry RACEMIC
Molecular Formula C22H25ClN2O3.ClH
Molecular Weight 437.359
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BIFEPROFEN HYDROCHLORIDE

SMILES

Cl.CC(C(=O)OCC(=O)N1CCN(C)CC1)C2=CC=C(C=C2)C3=CC=CC=C3Cl

InChI

InChIKey=IWFJFMHFGBSPBG-UHFFFAOYSA-N
InChI=1S/C22H25ClN2O3.ClH/c1-16(22(27)28-15-21(26)25-13-11-24(2)12-14-25)17-7-9-18(10-8-17)19-5-3-4-6-20(19)23;/h3-10,16H,11-15H2,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C22H25ClN2O3
Molecular Weight 400.899
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:51:49 GMT 2023
Edited
by admin
on Sat Dec 16 10:51:49 GMT 2023
Record UNII
2X6J3HCI13
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BIFEPROFEN HYDROCHLORIDE
Common Name English
(1,1'-BIPHENYL)-4-ACETIC ACID, 2'-CHLORO-.ALPHA.-METHYL-, 2-(4-METHYL-1-PIPERAZINYL)-2-OXOETHYL ESTER, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
2X6J3HCI13
Created by admin on Sat Dec 16 10:51:49 GMT 2023 , Edited by admin on Sat Dec 16 10:51:49 GMT 2023
PRIMARY
CAS
87359-06-6
Created by admin on Sat Dec 16 10:51:49 GMT 2023 , Edited by admin on Sat Dec 16 10:51:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID401007500
Created by admin on Sat Dec 16 10:51:49 GMT 2023 , Edited by admin on Sat Dec 16 10:51:49 GMT 2023
PRIMARY
PUBCHEM
3071131
Created by admin on Sat Dec 16 10:51:49 GMT 2023 , Edited by admin on Sat Dec 16 10:51:49 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE