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Details

Stereochemistry ACHIRAL
Molecular Formula C6H14S
Molecular Weight 118.24
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Methyl-3-pentanethiol

SMILES

CCC(C)(S)CC

InChI

InChIKey=AJWVDGABWLKIGT-UHFFFAOYSA-N
InChI=1S/C6H14S/c1-4-6(3,7)5-2/h7H,4-5H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C6H14S
Molecular Weight 118.24
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 17:46:03 GMT 2025
Edited
by admin
on Tue Apr 01 17:46:03 GMT 2025
Record UNII
C37FZ8G73Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Methyl-3-pentanethiol
Systematic Name English
3-Methylpentane-3-thiol
Preferred Name English
3-Pentanethiol, 3-methyl-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
216-677-2
Created by admin on Tue Apr 01 17:46:03 GMT 2025 , Edited by admin on Tue Apr 01 17:46:03 GMT 2025
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FDA UNII
C37FZ8G73Y
Created by admin on Tue Apr 01 17:46:03 GMT 2025 , Edited by admin on Tue Apr 01 17:46:03 GMT 2025
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CAS
1639-03-8
Created by admin on Tue Apr 01 17:46:03 GMT 2025 , Edited by admin on Tue Apr 01 17:46:03 GMT 2025
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EPA CompTox
DTXSID70167674
Created by admin on Tue Apr 01 17:46:03 GMT 2025 , Edited by admin on Tue Apr 01 17:46:03 GMT 2025
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PUBCHEM
74226
Created by admin on Tue Apr 01 17:46:03 GMT 2025 , Edited by admin on Tue Apr 01 17:46:03 GMT 2025
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