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

Details

Stereochemistry RACEMIC
Molecular Formula C9H20O
Molecular Weight 144.2545
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-METHYLOCTANOL

SMILES

CCCCCCC(C)CO

InChI

InChIKey=IGVGCQGTEINVOH-UHFFFAOYSA-N
InChI=1S/C9H20O/c1-3-4-5-6-7-9(2)8-10/h9-10H,3-8H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
2-METHYLOCTANOL
Systematic Name English
1-HYDROXY-2-METHYLOCTANE
Preferred Name English
2-METHYL-1-OCTANOL
Systematic Name English
1-OCTANOL, 2-METHYL-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
212-457-5
Created by admin on Mon Mar 31 22:15:31 GMT 2025 , Edited by admin on Mon Mar 31 22:15:31 GMT 2025
PRIMARY
CAS
818-81-5
Created by admin on Mon Mar 31 22:15:31 GMT 2025 , Edited by admin on Mon Mar 31 22:15:31 GMT 2025
PRIMARY
EPA CompTox
DTXSID20862425
Created by admin on Mon Mar 31 22:15:31 GMT 2025 , Edited by admin on Mon Mar 31 22:15:31 GMT 2025
PRIMARY
FDA UNII
4FT7336DZ7
Created by admin on Mon Mar 31 22:15:31 GMT 2025 , Edited by admin on Mon Mar 31 22:15:31 GMT 2025
PRIMARY
PUBCHEM
102495
Created by admin on Mon Mar 31 22:15:31 GMT 2025 , Edited by admin on Mon Mar 31 22:15:31 GMT 2025
PRIMARY