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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H12O
Molecular Weight 100.1589
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-PENTEN-4-OL, 4-METHYL-

SMILES

CC=CC(C)(C)O

InChI

InChIKey=OWVUFBAJXKEVBE-UHFFFAOYSA-N
InChI=1S/C6H12O/c1-4-5-6(2,3)7/h4-5,7H,1-3H3

HIDE SMILES / InChI

Molecular Formula C6H12O
Molecular Weight 100.1589
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:32:49 GMT 2025
Edited
by admin
on Mon Mar 31 19:32:49 GMT 2025
Record UNII
93TKK4GWH6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-PENTEN-4-OL, 4-METHYL-
Systematic Name English
3-PENTEN-2-OL, 2-METHYL-
Preferred Name English
4-METHYL-2-PENTEN-4-OL
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50871449
Created by admin on Mon Mar 31 19:32:49 GMT 2025 , Edited by admin on Mon Mar 31 19:32:49 GMT 2025
PRIMARY
PUBCHEM
112680
Created by admin on Mon Mar 31 19:32:49 GMT 2025 , Edited by admin on Mon Mar 31 19:32:49 GMT 2025
PRIMARY
FDA UNII
93TKK4GWH6
Created by admin on Mon Mar 31 19:32:49 GMT 2025 , Edited by admin on Mon Mar 31 19:32:49 GMT 2025
PRIMARY
CAS
63468-05-3
Created by admin on Mon Mar 31 19:32:49 GMT 2025 , Edited by admin on Mon Mar 31 19:32:49 GMT 2025
PRIMARY