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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H18O2
Molecular Weight 194.2701
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-METHYLOL-2-METHYL-4-TERT-BUTYLPHENOL

SMILES

CC1=C(O)C(CO)=CC(=C1)C(C)(C)C

InChI

InChIKey=CGVFFLCPRBKKQO-UHFFFAOYSA-N
InChI=1S/C12H18O2/c1-8-5-10(12(2,3)4)6-9(7-13)11(8)14/h5-6,13-14H,7H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C12H18O2
Molecular Weight 194.2701
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 23:16:37 GMT 2025
Edited
by admin
on Mon Mar 31 23:16:37 GMT 2025
Record UNII
65O102HXP5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-METHYLOL-2-METHYL-4-TERT-BUTYLPHENOL
Systematic Name English
5-TERT-BUTYL-3-METHYL-SALIGENIN
Preferred Name English
SALIGENIN, 5-TERT-BUTYL-3-METHYL-
Common Name English
BENZYL ALCOHOL, 5-TERT-BUTYL-2-HYDROXY-3-METHYL-
Systematic Name English
BENZENEMETHANOL, 5-(1,1-DIMETHYLETHYL)-2-HYDROXY-3-METHYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID401206417
Created by admin on Mon Mar 31 23:16:37 GMT 2025 , Edited by admin on Mon Mar 31 23:16:37 GMT 2025
PRIMARY
CAS
13464-23-8
Created by admin on Mon Mar 31 23:16:37 GMT 2025 , Edited by admin on Mon Mar 31 23:16:37 GMT 2025
PRIMARY
FDA UNII
65O102HXP5
Created by admin on Mon Mar 31 23:16:37 GMT 2025 , Edited by admin on Mon Mar 31 23:16:37 GMT 2025
PRIMARY
PUBCHEM
12545257
Created by admin on Mon Mar 31 23:16:37 GMT 2025 , Edited by admin on Mon Mar 31 23:16:37 GMT 2025
PRIMARY