5-[2-Hydroxy-3-(methylthio)propoxy]-4-oxo-4H-1-benzopyran-2-carboxylic acid

CAS Registry Number®

77005-28-8

CAS Name

5-[2-Hydroxy-3-(methylthio)propoxy]-4-oxo-4H-1-benzopyran-2-carboxylic acid

Molecular Formula

C14H14O6S

Molecular Mass

310.32

Cite this Page

5-[2-Hydroxy-3-(methylthio)propoxy]-4-oxo-4H-1-benzopyran-2-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=77005-28-8 (retrieved 2025-01-05) (CAS RN: 77005-28-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H14O6S/c1-21-7-8(15)6-19-10-3-2-4-11-13(10)9(16)5-12(20-11)14(17)18/h2-5,8,15H,6-7H2,1H3,(H,17,18)

InChIKey

InChIKey=CMPCNRFIRDPVAN-UHFFFAOYSA-N

SMILES

O(CC(CSC)O)C1=C2C(OC(C(O)=O)=CC2=O)=CC=C1

Canonical SMILES

O=C(O)C=1OC2=CC=CC(OCC(O)CSC)=C2C(=O)C1

Other Names for this Substance

  • 4H-1-Benzopyran-2-carboxylic acid, 5-[2-hydroxy-3-(methylthio)propoxy]-4-oxo-
  • 5-[2-Hydroxy-3-(methylthio)propoxy]-4-oxo-4H-1-benzopyran-2-carboxylic acid
  • Texacromil

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