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Details

Stereochemistry RACEMIC
Molecular Formula C7H14O2S
Molecular Weight 162.25
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 3-(METHYLTHIO)BUTYRATE

SMILES

CCOC(=O)CC(C)SC

InChI

InChIKey=OBOGJNGOEGQVPL-UHFFFAOYSA-N
InChI=1S/C7H14O2S/c1-4-9-7(8)5-6(2)10-3/h6H,4-5H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C7H14O2S
Molecular Weight 162.25
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:37:22 GMT 2023
Edited
by admin
on Fri Dec 15 19:37:22 GMT 2023
Record UNII
K3KKZ020B3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 3-(METHYLTHIO)BUTYRATE
FHFI  
Systematic Name English
FEMA NO. 3836
Code English
TROPICAL 3-THIOBUTYRATE
Common Name English
ETHYL 3-METHYLSULFANYLBUTANOATE
Systematic Name English
ETHYL 3-(METHYLTHIO)BUTYRATE [FHFI]
Common Name English
BUTANOIC ACID, 3-(METHYLTHIO)-, ETHYL ESTER
Common Name English
Classification Tree Code System Code
JECFA EVALUATION ETHYL 3-(METHYLTHIO)BUTYRATE
Created by admin on Fri Dec 15 19:37:22 GMT 2023 , Edited by admin on Fri Dec 15 19:37:22 GMT 2023
Code System Code Type Description
PUBCHEM
22213645
Created by admin on Fri Dec 15 19:37:22 GMT 2023 , Edited by admin on Fri Dec 15 19:37:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID20946037
Created by admin on Fri Dec 15 19:37:22 GMT 2023 , Edited by admin on Fri Dec 15 19:37:22 GMT 2023
PRIMARY
JECFA MONOGRAPH
522
Created by admin on Fri Dec 15 19:37:22 GMT 2023 , Edited by admin on Fri Dec 15 19:37:22 GMT 2023
PRIMARY
CAS
233665-96-8
Created by admin on Fri Dec 15 19:37:22 GMT 2023 , Edited by admin on Fri Dec 15 19:37:22 GMT 2023
PRIMARY
FDA UNII
K3KKZ020B3
Created by admin on Fri Dec 15 19:37:22 GMT 2023 , Edited by admin on Fri Dec 15 19:37:22 GMT 2023
PRIMARY