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Details

Stereochemistry RACEMIC
Molecular Formula C8H16OS
Molecular Weight 160.277
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-MERCAPTOOCTANAL

SMILES

CCCCCC(S)CC=O

InChI

InChIKey=CQZARDZYAZYHBT-UHFFFAOYSA-N
InChI=1S/C8H16OS/c1-2-3-4-5-8(10)6-7-9/h7-8,10H,2-6H2,1H3

HIDE SMILES / InChI

Molecular Formula C8H16OS
Molecular Weight 160.277
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:42:54 GMT 2023
Edited
by admin
on Sat Dec 16 10:42:54 GMT 2023
Record UNII
4PRF1QK2S4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-MERCAPTOOCTANAL
Systematic Name English
OCTANAL, 3-MERCAPTO-
Systematic Name English
Code System Code Type Description
CAS
473438-39-0
Created by admin on Sat Dec 16 10:42:54 GMT 2023 , Edited by admin on Sat Dec 16 10:42:54 GMT 2023
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FDA UNII
4PRF1QK2S4
Created by admin on Sat Dec 16 10:42:54 GMT 2023 , Edited by admin on Sat Dec 16 10:42:54 GMT 2023
PRIMARY
EPA CompTox
DTXSID001019824
Created by admin on Sat Dec 16 10:42:54 GMT 2023 , Edited by admin on Sat Dec 16 10:42:54 GMT 2023
PRIMARY
PUBCHEM
527442
Created by admin on Sat Dec 16 10:42:54 GMT 2023 , Edited by admin on Sat Dec 16 10:42:54 GMT 2023
PRIMARY