Calcium 4-Nitrophenolate
[CAS# 34005-60-2]

Identification

• Name: Calcium 4-Nitrophenolate
• Synonyms: Phenol, P-Nitro-, Calcium Salt; P-Nitrophenol Calcium Salt
• Molecular Formula: C₁₂H₈CaN₂O₆
• Molecular Weight: 316.29
• CAS Registry Number: 34005-60-2
• SMILES: C1=C([N+](=O)[O-])C=CC(=C1)[O-].C2=C([N+]([O-])=O)C=CC(=C2)[O-].[Ca++]
• InChI: 1S/2C6H5NO3.Ca/c2*8-6-3-1-5(2-4-6)7(9)10;/h2*1-4,8H;/q;;+2/p-2
• InChIKey: IELLGWCBQATIRX-UHFFFAOYSA-L

Properties

• Boiling point: 279°C at 760 mmHg (Cal.)
• Flash point: 141.9°C (Cal.)