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Details

Stereochemistry ACHIRAL
Molecular Formula C4H6O2S
Molecular Weight 118.154
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-(METHYLTHIO)ACRYLIC ACID, (E)-

SMILES

CS\C=C\C(O)=O

InChI

InChIKey=RCZLOQQOUWHMIS-NSCUHMNNSA-N
InChI=1S/C4H6O2S/c1-7-3-2-4(5)6/h2-3H,1H3,(H,5,6)/b3-2+

HIDE SMILES / InChI

Molecular Formula C4H6O2S
Molecular Weight 118.154
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 Sat Dec 16 10:45:58 UTC 2023
Edited
by admin
on Sat Dec 16 10:45:58 UTC 2023
Record UNII
9C2XEZ8RWS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(METHYLTHIO)ACRYLIC ACID, (E)-
Systematic Name English
TRANS-METHYLTHIOACRYLIC ACID
Systematic Name English
TRANS-3-(METHYLTHIO)ACRYLIC ACID
Systematic Name English
(E)-3-(METHYLTHIO)ACRYLIC ACID
Systematic Name English
2-PROPENOIC ACID, 3-(METHYLTHIO)-, (2E)-
Systematic Name English
(2E)-3-(METHYLSULFANYL)PROP-2-ENOIC ACID
Systematic Name English
ACRYLIC ACID, 3-(METHYLTHIO)-, (E)-
Systematic Name English
TRANS-THIOMETHYL ACRYLIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
6441475
Created by admin on Sat Dec 16 10:45:58 UTC 2023 , Edited by admin on Sat Dec 16 10:45:58 UTC 2023
PRIMARY
FDA UNII
9C2XEZ8RWS
Created by admin on Sat Dec 16 10:45:58 UTC 2023 , Edited by admin on Sat Dec 16 10:45:58 UTC 2023
PRIMARY
CAS
26398-93-6
Created by admin on Sat Dec 16 10:45:58 UTC 2023 , Edited by admin on Sat Dec 16 10:45:58 UTC 2023
PRIMARY
EPA CompTox
DTXSID901290437
Created by admin on Sat Dec 16 10:45:58 UTC 2023 , Edited by admin on Sat Dec 16 10:45:58 UTC 2023
PRIMARY
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