Benzo[b]thiophene-6-carboxylic acid, 4,5-dihydro-2-(1H-imidazol-1-ylmethyl)-, sodium salt (1:1)

CAS Registry Number®

113817-57-5

CAS Name

Benzo[b]thiophene-6-carboxylic acid, 4,5-dihydro-2-(1H-imidazol-1-ylmethyl)-, sodium salt (1:1)

Molecular Formula

C13H12N2O2S.Na

Cite this Page

Benzo[b]thiophene-6-carboxylic acid, 4,5-dihydro-2-(1H-imidazol-1-ylmethyl)-, sodium salt (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=113817-57-5 (retrieved 2024-11-22) (CAS RN: 113817-57-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    >300 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C13H12N2O2S.Na/c16-13(17)10-2-1-9-5-11(18-12(9)6-10)7-15-4-3-14-8-15;/h3-6,8H,1-2,7H2,(H,16,17);

InChIKey

InChIKey=PLWYYRJTTTZSBZ-UHFFFAOYSA-N

SMILES

C(C=1SC2=C(C1)CCC(C(O)=O)=C2)N3C=CN=C3.[Na]

Canonical SMILES

[Na].O=C(O)C1=CC=2SC(=CC2CC1)CN3C=NC=C3

Other Names for this Substance

  • Benzo[b]thiophene-6-carboxylic acid, 4,5-dihydro-2-(1H-imidazol-1-ylmethyl)-, sodium salt (1:1)
  • Benzo[b]thiophene-6-carboxylic acid, 4,5-dihydro-2-(1H-imidazol-1-ylmethyl)-, sodium salt
  • RS 5186
  • CS 518

CAS INSIGHTSTM
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