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

Details

Stereochemistry RACEMIC
Molecular Formula C6H14OS
Molecular Weight 134.24
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-MERCAPTO-2-METHYLPENTAN-1-OL

SMILES

CCCC(C)(S)CO

InChI

InChIKey=KMWFJTAZFAREIH-UHFFFAOYSA-N
InChI=1S/C6H14OS/c1-3-4-6(2,8)5-7/h7-8H,3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C6H14OS
Molecular Weight 134.24
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 20:07:23 GMT 2025
Edited
by admin
on Mon Mar 31 20:07:23 GMT 2025
Record UNII
600J834MPF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FEMA NO. 3995
Preferred Name English
2-MERCAPTO-2-METHYLPENTAN-1-OL
Systematic Name English
1-PENTANOL, 2-MERCAPTO-2-METHYL-
Systematic Name English
2-MERCAPTO-2-METHYL-1-PENTANOL
Systematic Name English
(±)-2-MERCAPTO-2-METHYLPENTAN-1-OL [FHFI]
Common Name English
2-MERCAPTO-2-METHYLPENTAN-1-OL, (±)-
Systematic Name English
Code System Code Type Description
FDA UNII
600J834MPF
Created by admin on Mon Mar 31 20:07:23 GMT 2025 , Edited by admin on Mon Mar 31 20:07:23 GMT 2025
PRIMARY
JECFA MONOGRAPH
1299
Created by admin on Mon Mar 31 20:07:23 GMT 2025 , Edited by admin on Mon Mar 31 20:07:23 GMT 2025
PRIMARY
EPA CompTox
DTXSID00888264
Created by admin on Mon Mar 31 20:07:23 GMT 2025 , Edited by admin on Mon Mar 31 20:07:23 GMT 2025
PRIMARY
PUBCHEM
11240503
Created by admin on Mon Mar 31 20:07:23 GMT 2025 , Edited by admin on Mon Mar 31 20:07:23 GMT 2025
PRIMARY
CAS
258823-39-1
Created by admin on Mon Mar 31 20:07:23 GMT 2025 , Edited by admin on Mon Mar 31 20:07:23 GMT 2025
PRIMARY