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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H14O2
Molecular Weight 166.217
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-ISOBUTYLRESORCINOL

SMILES

CC(C)CC1=CC=C(O)C=C1O

InChI

InChIKey=IFVWLEMMYISKHW-UHFFFAOYSA-N
InChI=1S/C10H14O2/c1-7(2)5-8-3-4-9(11)6-10(8)12/h3-4,6-7,11-12H,5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C10H14O2
Molecular Weight 166.217
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:28:35 GMT 2025
Edited
by admin
on Mon Mar 31 21:28:35 GMT 2025
Record UNII
G9902W3HHX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IBR
Preferred Name English
4-ISOBUTYLRESORCINOL
INCI  
INCI  
Official Name English
1,3-BENZENEDIOL, 4-(2-METHYLPROPYL)-
Systematic Name English
RESORCINOL, 4-ISOBUTYL-
Systematic Name English
Code System Code Type Description
FDA UNII
G9902W3HHX
Created by admin on Mon Mar 31 21:28:35 GMT 2025 , Edited by admin on Mon Mar 31 21:28:35 GMT 2025
PRIMARY
CAS
18979-62-9
Created by admin on Mon Mar 31 21:28:35 GMT 2025 , Edited by admin on Mon Mar 31 21:28:35 GMT 2025
PRIMARY
PUBCHEM
13951085
Created by admin on Mon Mar 31 21:28:35 GMT 2025 , Edited by admin on Mon Mar 31 21:28:35 GMT 2025
PRIMARY
EPA CompTox
DTXSID10172404
Created by admin on Mon Mar 31 21:28:35 GMT 2025 , Edited by admin on Mon Mar 31 21:28:35 GMT 2025
PRIMARY