structure of Methyl 3-(5-methoxythiophen-2-yl)propanoate

Methyl 3-(5-methoxythiophen-2-yl)propanoate

CAS No.: 1000896-80-9
M. Wt: 200.25500
M. Fa: C9H12O3S
InChI Key: XPMLHYSGMCEJRI-UHFFFAOYSA-N

Names and Identifiers of 1000896-80-9

CAS Number

1000896-80-9

IUPAC Name

methyl 3-(5-methoxythiophen-2-yl)propanoate

InChI

InChI=1S/C9H12O3S/c1-11-8(10)5-3-7-4-6-9(12-2)13-7/h4,6H,3,5H2,1-2H3

InChIKey

XPMLHYSGMCEJRI-UHFFFAOYSA-N

Canonical SMILES

COC1=CC=C(S1)CCC(=O)OC

Physical and chemical properties of 1000896-80-9

Exact Mass

200.05100

LogP

1.86230

Molecular Formula

C9H12O3S

Molecular Weight

200.25500

PSA

63.77000

Applications of 1000896-80-9

Methyl 3-(5-methoxythiophen-2-yl)propanoate may find applications in several fields:

  • Flavoring Agents: Due to its aromatic properties, it could be utilized in food flavoring.
  • Fragrance Industry: Its unique scent profile may make it suitable for use in perfumes and cosmetics.
  • Pharmaceuticals: Potential applications in drug development due to its structural characteristics.