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Details

Stereochemistry ACHIRAL
Molecular Formula C8H14OS
Molecular Weight 158.261
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYL-2-(METHYLTHIOMETHYL)-2-PENTENAL

SMILES

CSC\C(C=O)=C\C(C)C

InChI

InChIKey=FNHVKVSDWQLOEU-XBXARRHUSA-N
InChI=1S/C8H14OS/c1-7(2)4-8(5-9)6-10-3/h4-5,7H,6H2,1-3H3/b8-4+

HIDE SMILES / InChI

Molecular Formula C8H14OS
Molecular Weight 158.261
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 20:32:21 GMT 2025
Edited
by admin
on Mon Mar 31 20:32:21 GMT 2025
Record UNII
1G46E74K99
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-METHYL-2-(METHYLTHIOMETHYL)-2-PENTENAL
Systematic Name English
FEMA NO. 4568
Preferred Name English
4-METHYL-2-((METHYLSULFANYL)- METHYL)PENT-2-ENAL
Systematic Name English
2-METHYLMERCAPTOMETHYL-4-METHYLPENT-2-ENAL
Systematic Name English
2-PENTENAL, 4-METHYL-2-((METHYLTHIO)METHYL)-
Systematic Name English
4-METHYL-2-(METHYLTHIOMETHYL)-2-PENTANAL
Common Name English
Code System Code Type Description
JECFA MONOGRAPH
1896
Created by admin on Mon Mar 31 20:32:21 GMT 2025 , Edited by admin on Mon Mar 31 20:32:21 GMT 2025
PRIMARY
EPA CompTox
DTXSID10193856
Created by admin on Mon Mar 31 20:32:21 GMT 2025 , Edited by admin on Mon Mar 31 20:32:21 GMT 2025
PRIMARY
FDA UNII
1G46E74K99
Created by admin on Mon Mar 31 20:32:21 GMT 2025 , Edited by admin on Mon Mar 31 20:32:21 GMT 2025
PRIMARY
PUBCHEM
71587152
Created by admin on Mon Mar 31 20:32:21 GMT 2025 , Edited by admin on Mon Mar 31 20:32:21 GMT 2025
PRIMARY
CAS
40878-73-7
Created by admin on Mon Mar 31 20:32:21 GMT 2025 , Edited by admin on Mon Mar 31 20:32:21 GMT 2025
PRIMARY