1-[(1S)-1-Phenylethyl]-1H-imidazole-5-carboxylic acid

CAS Registry Number®

56649-49-1
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CAS Name

1-[(1S)-1-Phenylethyl]-1H-imidazole-5-carboxylic acid

Molecular Formula

C12H12N2O2

Molecular Mass

216.24

Cite this Page

1-[(1S)-1-Phenylethyl]-1H-imidazole-5-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=56649-49-1 (retrieved 2024-05-17) (CAS RN: 56649-49-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    153-154.5 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C12H12N2O2/c1-9(10-5-3-2-4-6-10)14-8-13-7-11(14)12(15)16/h2-9H,1H3,(H,15,16)/t9-/m0/s1

InChIKey

InChIKey=RGYCCBLTSWHXIS-VIFPVBQESA-N

SMILES

[C@@H](C)(N1C(C(O)=O)=CN=C1)C2=CC=CC=C2

Canonical SMILES

O=C(O)C1=CN=CN1C(C=2C=CC=CC2)C

Other Names for this Substance

  • 1H-Imidazole-5-carboxylic acid, 1-[(1S)-1-phenylethyl]-
  • 1H-Imidazole-5-carboxylic acid, 1-(1-phenylethyl)-, (S)-
  • 1-[(1S)-1-Phenylethyl]-1H-imidazole-5-carboxylic acid
  • 1-[(1S)-1-Phenylethyl]-1H-imidazole-5-carboxylic acid

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