Calcium 2-Phenylacetate
[CAS# 52009-49-1]

Identification

• Name: Calcium 2-Phenylacetate
• Synonyms: Calcium 2-Phenylethanoate; Calcium Bis(Phenylacetate)
• Molecular Formula: C₁₆H₁₄CaO₄
• Molecular Weight: 310.36
• CAS Registry Number: 52009-49-1
• EINECS: 257-600-2
• SMILES: C1=C(CC([O-])=O)C=CC=C1.C(C2=CC=CC=C2)C([O-])=O.[Ca++]
• InChI: 1S/2C8H8O2.Ca/c2*9-8(10)6-7-4-2-1-3-5-7;/h2*1-5H,6H2,(H,9,10);/q;;+2/p-2
• InChIKey: XWSRCZGIHKNZFL-UHFFFAOYSA-L

Properties

• Boiling point: 265.5°C at 760 mmHg (Cal.)
• Flash point: 156.2°C (Cal.)