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

Details

Stereochemistry ABSOLUTE
Molecular Formula C11H16O
Molecular Weight 164.2441
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FENIPENTOL, (S)-

SMILES

CCCC[C@H](O)C1=CC=CC=C1

InChI

InChIKey=OVGORFFCBUIFIA-NSHDSACASA-N
InChI=1S/C11H16O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8,11-12H,2-3,9H2,1H3/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C11H16O
Molecular Weight 164.2441
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:27:20 UTC 2023
Edited
by admin
on Sat Dec 16 01:27:20 UTC 2023
Record UNII
O1GKM42V1D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FENIPENTOL, (S)-
Common Name English
BENZENEMETHANOL, .ALPHA.-BUTYL-, (.ALPHA.S)-
Common Name English
(-)-.ALPHA.-BUTYLBENZYL ALCOHOL
Systematic Name English
S-(-)-1-PHENYLPENTAN-1-OL
Common Name English
(S)-.ALPHA.-BUTYLBENZENEMETHANOL
Systematic Name English
(-)-1-PHENYLPENTAN-1-OL
Systematic Name English
(.ALPHA.S)-.ALPHA.-BUTYLBENZENEMETHANOL
Common Name English
BENZENEMETHANOL, .ALPHA.-BUTYL-, (S)-
Systematic Name English
.ALPHA.-BUTYLBENZYL ALCOHOL, (-)-
Systematic Name English
BENZYL ALCOHOL, .ALPHA.-BUTYL-, (S)-(-)-
Systematic Name English
Code System Code Type Description
CAS
33652-83-4
Created by admin on Sat Dec 16 01:27:20 UTC 2023 , Edited by admin on Sat Dec 16 01:27:20 UTC 2023
PRIMARY
FDA UNII
O1GKM42V1D
Created by admin on Sat Dec 16 01:27:20 UTC 2023 , Edited by admin on Sat Dec 16 01:27:20 UTC 2023
PRIMARY
EPA CompTox
DTXSID10187336
Created by admin on Sat Dec 16 01:27:20 UTC 2023 , Edited by admin on Sat Dec 16 01:27:20 UTC 2023
PRIMARY
PUBCHEM
6992754
Created by admin on Sat Dec 16 01:27:20 UTC 2023 , Edited by admin on Sat Dec 16 01:27:20 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER