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

Details

Stereochemistry ABSOLUTE
Molecular Formula C13H20O
Molecular Weight 192.2973
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IBUPROFEN ALCOHOL, (+)-

SMILES

CC(C)CC1=CC=C(C=C1)[C@@H](C)CO

InChI

InChIKey=IZXWIWYERZDWOA-NSHDSACASA-N
InChI=1S/C13H20O/c1-10(2)8-12-4-6-13(7-5-12)11(3)9-14/h4-7,10-11,14H,8-9H2,1-3H3/t11-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
IBUPROFEN ALCOHOL, (+)-
Common Name English
BENZENEETHANOL, .BETA.-METHYL-4-(2-METHYLPROPYL)-, (R)-
Systematic Name English
BENZENEETHANOL, .BETA.-METHYL-4-(2-METHYLPROPYL)-, (.BETA.R)-
Common Name English
Code System Code Type Description
PUBCHEM
53944194
Created by admin on Sat Dec 16 09:57:50 GMT 2023 , Edited by admin on Sat Dec 16 09:57:50 GMT 2023
PRIMARY
FDA UNII
14TRB9JHZ8
Created by admin on Sat Dec 16 09:57:50 GMT 2023 , Edited by admin on Sat Dec 16 09:57:50 GMT 2023
PRIMARY
CAS
93673-13-3
Created by admin on Sat Dec 16 09:57:50 GMT 2023 , Edited by admin on Sat Dec 16 09:57:50 GMT 2023
PRIMARY