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Details

Stereochemistry ACHIRAL
Molecular Formula C9H12O3S
Molecular Weight 200.255
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 3-(FURFURYLTHIO)PROPIONATE

SMILES

COC(=O)CCSCC1=CC=CO1

InChI

InChIKey=MXXNUXUTQGTBGJ-UHFFFAOYSA-N
InChI=1S/C9H12O3S/c1-11-9(10)4-6-13-7-8-3-2-5-12-8/h2-3,5H,4,6-7H2,1H3

HIDE SMILES / InChI

Molecular Formula C9H12O3S
Molecular Weight 200.255
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 20:41:02 GMT 2025
Edited
by admin
on Mon Mar 31 20:41:02 GMT 2025
Record UNII
L1387H8Y3U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL 3-(FURFURYLTHIO)PROPIONATE
Systematic Name English
FEMA NO. 4538
Preferred Name English
METHYL FURFURYL MERCAPTOPROPIONATE
Common Name English
PROPANOIC ACID, 3-((2-FURANYLMETHYL)THIO)-, METHYL ESTER
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID50869225
Created by admin on Mon Mar 31 20:41:02 GMT 2025 , Edited by admin on Mon Mar 31 20:41:02 GMT 2025
PRIMARY
ECHA (EC/EINECS)
304-715-1
Created by admin on Mon Mar 31 20:41:02 GMT 2025 , Edited by admin on Mon Mar 31 20:41:02 GMT 2025
PRIMARY
FDA UNII
L1387H8Y3U
Created by admin on Mon Mar 31 20:41:02 GMT 2025 , Edited by admin on Mon Mar 31 20:41:02 GMT 2025
PRIMARY
CAS
94278-26-9
Created by admin on Mon Mar 31 20:41:02 GMT 2025 , Edited by admin on Mon Mar 31 20:41:02 GMT 2025
PRIMARY
PUBCHEM
15225386
Created by admin on Mon Mar 31 20:41:02 GMT 2025 , Edited by admin on Mon Mar 31 20:41:02 GMT 2025
PRIMARY
JECFA MONOGRAPH
2071
Created by admin on Mon Mar 31 20:41:02 GMT 2025 , Edited by admin on Mon Mar 31 20:41:02 GMT 2025
PRIMARY