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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H20O
Molecular Weight 192.2973
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of M-CRESOL, 2,4-DIISOPROPYL-

SMILES

CC(C)C1=CC=C(O)C(C(C)C)=C1C

InChI

InChIKey=NAOSNNNYJHAZGY-UHFFFAOYSA-N
InChI=1S/C13H20O/c1-8(2)11-6-7-12(14)13(9(3)4)10(11)5/h6-9,14H,1-5H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2,4-DIISOPROPYL-M-CRESOL
Preferred Name English
M-CRESOL, 2,4-DIISOPROPYL-
Systematic Name English
DIISOPROPYL-M-CRESOL
Systematic Name English
PHENOL, 3-METHYL-2,4-BIS(1-METHYLETHYL)-
Systematic Name English
3-METHYL-2,4-DIISOPROPYLPHENOL
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70891386
Created by admin on Mon Mar 31 19:35:23 GMT 2025 , Edited by admin on Mon Mar 31 19:35:23 GMT 2025
PRIMARY
FDA UNII
5Y3P3E682S
Created by admin on Mon Mar 31 19:35:23 GMT 2025 , Edited by admin on Mon Mar 31 19:35:23 GMT 2025
PRIMARY
PUBCHEM
169279
Created by admin on Mon Mar 31 19:35:23 GMT 2025 , Edited by admin on Mon Mar 31 19:35:23 GMT 2025
PRIMARY
CAS
76138-69-7
Created by admin on Mon Mar 31 19:35:23 GMT 2025 , Edited by admin on Mon Mar 31 19:35:23 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966