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Details

Stereochemistry ACHIRAL
Molecular Formula C7H14O2S
Molecular Weight 162.25
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Butyl (methylthio)acetate

SMILES

CCCCOC(=O)CSC

InChI

InChIKey=QXJSYAFLDDZIQI-UHFFFAOYSA-N
InChI=1S/C7H14O2S/c1-3-4-5-9-7(8)6-10-2/h3-6H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Acetic acid, (methylthio)-, butyl ester
Preferred Name English
Butyl (methylthio)acetate
Systematic Name English
Butyl 2-(methylthio)acetate
Systematic Name English
Acetic acid, 2-(methylthio)-, butyl ester
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID5070577
Created by admin on Tue Apr 01 17:52:55 GMT 2025 , Edited by admin on Tue Apr 01 17:52:55 GMT 2025
PRIMARY
FDA UNII
QN58WY5942
Created by admin on Tue Apr 01 17:52:55 GMT 2025 , Edited by admin on Tue Apr 01 17:52:55 GMT 2025
PRIMARY
CAS
67746-25-2
Created by admin on Tue Apr 01 17:52:55 GMT 2025 , Edited by admin on Tue Apr 01 17:52:55 GMT 2025
PRIMARY
ECHA (EC/EINECS)
266-987-7
Created by admin on Tue Apr 01 17:52:55 GMT 2025 , Edited by admin on Tue Apr 01 17:52:55 GMT 2025
PRIMARY
PUBCHEM
105572
Created by admin on Tue Apr 01 17:52:55 GMT 2025 , Edited by admin on Tue Apr 01 17:52:55 GMT 2025
PRIMARY
NIH
NCATS
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