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Details

Stereochemistry ABSOLUTE
Molecular Formula C4H10OS
Molecular Weight 106.187
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-MERCAPTO-2-BUTANOL, (2S,3S)-

SMILES

C[C@H](O)[C@H](C)S

InChI

InChIKey=MJQWABQELVFQJL-IMJSIDKUSA-N
InChI=1S/C4H10OS/c1-3(5)4(2)6/h3-6H,1-2H3/t3-,4-/m0/s1

HIDE SMILES / InChI

Molecular Formula C4H10OS
Molecular Weight 106.187
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:09:57 GMT 2023
Edited
by admin
on Sat Dec 16 08:09:57 GMT 2023
Record UNII
NLU8ZZC6D3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-MERCAPTO-2-BUTANOL, (2S,3S)-
Systematic Name English
2-BUTANOL, 3-MERCAPTO-, (2S,3S)-
Systematic Name English
Code System Code Type Description
CAS
846047-56-1
Created by admin on Sat Dec 16 08:09:57 GMT 2023 , Edited by admin on Sat Dec 16 08:09:57 GMT 2023
PRIMARY
PUBCHEM
40487526
Created by admin on Sat Dec 16 08:09:57 GMT 2023 , Edited by admin on Sat Dec 16 08:09:57 GMT 2023
PRIMARY
FDA UNII
NLU8ZZC6D3
Created by admin on Sat Dec 16 08:09:57 GMT 2023 , Edited by admin on Sat Dec 16 08:09:57 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER
DIASTEREOISOMER -> DIASTEREOISOMER
ENANTIOMER -> ENANTIOMER
DIASTEREOISOMER -> DIASTEREOISOMER