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

Details

Stereochemistry RACEMIC
Molecular Formula C8H18O
Molecular Weight 130.2279
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-ETHYL-4-METHYLPENTANOL

SMILES

CCC(CO)CC(C)C

InChI

InChIKey=QCHSJPKDWOFACC-UHFFFAOYSA-N
InChI=1S/C8H18O/c1-4-8(6-9)5-7(2)3/h7-9H,4-6H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C8H18O
Molecular Weight 130.2279
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:04:33 GMT 2025
Edited
by admin
on Mon Mar 31 21:04:33 GMT 2025
Record UNII
80V2E9GXUZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-PENTANOL, 2-ETHYL-4-METHYL-
Preferred Name English
2-ETHYL-4-METHYLPENTANOL
Systematic Name English
2-ETHYL-4-METHYLPENTAN-1-OL
Systematic Name English
2-ETHYL-4-METHYL-1-PENTANOL
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
203-422-5
Created by admin on Mon Mar 31 21:04:33 GMT 2025 , Edited by admin on Mon Mar 31 21:04:33 GMT 2025
PRIMARY
EPA CompTox
DTXSID90861723
Created by admin on Mon Mar 31 21:04:33 GMT 2025 , Edited by admin on Mon Mar 31 21:04:33 GMT 2025
PRIMARY
CAS
106-67-2
Created by admin on Mon Mar 31 21:04:33 GMT 2025 , Edited by admin on Mon Mar 31 21:04:33 GMT 2025
PRIMARY
PUBCHEM
7821
Created by admin on Mon Mar 31 21:04:33 GMT 2025 , Edited by admin on Mon Mar 31 21:04:33 GMT 2025
PRIMARY
FDA UNII
80V2E9GXUZ
Created by admin on Mon Mar 31 21:04:33 GMT 2025 , Edited by admin on Mon Mar 31 21:04:33 GMT 2025
PRIMARY