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Calcium phenylpyruvate

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Catalog Number

ACM51828934-1

Product Name

Structure

CAS

51828-93-4

Synonyms

Calcium alpha-ketophenylalanine

IUPAC Name

Calcium;2-oxo-3-phenylpropanoate

Molecular Weight

206.25

Molecular Formula

C9H10CaO3

Canonical SMILES

C1=CC=C(C=C1)CC(=O)C(=O)[O-].C1=CC=C(C=C1)CC(=O)C(=O)[O-].[Ca+2]

InChI

InChI=1S/2C9H8O3.Ca/c2*10-8(9(11)12)6-7-4-2-1-3-5-7;/h2*1-5H,6H2,(H,11,12);/q;;+2/p-2

InChI Key

BKMMOJVSLBZNTK-UHFFFAOYSA-L

Melting Point

172 °C (dec.)

Purity

98%

Appearance

White to off-white solid

Storage

room temperature

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