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Details

Stereochemistry ABSOLUTE
Molecular Formula C5H12OS
Molecular Weight 120.213
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-METHYL-3-SULFANYL-BUTAN-1-OL, (2S,3R)-

SMILES

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

InChI

InChIKey=RFMHFOPFUZZBAD-CRCLSJGQSA-N
InChI=1S/C5H12OS/c1-4(3-6)5(2)7/h4-7H,3H2,1-2H3/t4-,5+/m0/s1

HIDE SMILES / InChI

Molecular Formula C5H12OS
Molecular Weight 120.213
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 Fri Dec 15 20:18:57 GMT 2023
Edited
by admin
on Fri Dec 15 20:18:57 GMT 2023
Record UNII
33D3066200
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-METHYL-3-SULFANYL-BUTAN-1-OL, (2S,3R)-
Systematic Name English
1-BUTANOL, 3-MERCAPTO-2-METHYL-, (2S,3R)-
Systematic Name English
(2S,3R)-2-METHYL-3-SULFANYL-BUTAN-1-OL
Systematic Name English
FEMA NO. 3993, (2,3R)-
Code English
Code System Code Type Description
FDA UNII
33D3066200
Created by admin on Fri Dec 15 20:18:57 GMT 2023 , Edited by admin on Fri Dec 15 20:18:57 GMT 2023
PRIMARY
EPA CompTox
DTXSID80217058
Created by admin on Fri Dec 15 20:18:57 GMT 2023 , Edited by admin on Fri Dec 15 20:18:57 GMT 2023
PRIMARY
PUBCHEM
10197674
Created by admin on Fri Dec 15 20:18:57 GMT 2023 , Edited by admin on Fri Dec 15 20:18:57 GMT 2023
PRIMARY
CAS
669070-06-8
Created by admin on Fri Dec 15 20:18:57 GMT 2023 , Edited by admin on Fri Dec 15 20:18:57 GMT 2023
PRIMARY