2-[4-(2-Carboxypropoxy)-3-cyanophenyl]-4-methyl-5-thiazolecarboxylic acid

CAS Registry Number®

407582-49-4
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CAS Name

2-[4-(2-Carboxypropoxy)-3-cyanophenyl]-4-methyl-5-thiazolecarboxylic acid

Molecular Formula

C16H14N2O5S

Molecular Mass

346.36

Cite this Page

2-[4-(2-Carboxypropoxy)-3-cyanophenyl]-4-methyl-5-thiazolecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=407582-49-4 (retrieved 2024-03-04) (CAS RN: 407582-49-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    208-211 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H14N2O5S/c1-8(15(19)20)7-23-12-4-3-10(5-11(12)6-17)14-18-9(2)13(24-14)16(21)22/h3-5,8H,7H2,1-2H3,(H,19,20)(H,21,22)

InChIKey

InChIKey=LCBACLAPKJRMIF-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1SC(=NC1C)C2=CC(C#N)=C(OCC(C(O)=O)C)C=C2

Canonical SMILES

N#CC=1C=C(C=CC1OCC(C(=O)O)C)C2=NC(=C(S2)C(=O)O)C

Other Names for this Substance

  • 5-Thiazolecarboxylic acid, 2-[4-(2-carboxypropoxy)-3-cyanophenyl]-4-methyl-
  • 2-[4-(2-Carboxypropoxy)-3-cyanophenyl]-4-methyl-5-thiazolecarboxylic acid

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