Benzoylpas Calcium Pentahydrate
[CAS# 5631-00-5]

Identification

• Name: Benzoylpas Calcium Pentahydrate
• Synonyms: 4-Benzamido-2-Hydroxy-Benzoic Acid; Calcium; Pentahydrate; Benzoic Acid, 4-(Benzoylamino)-2-Hydroxy-, Calcium Salt (2:1) Pentahydrate; Benzoylpas Calcium
• Molecular Formula: C₂₈H₃₂CaN₂O₁₃
• Molecular Weight: 644.65
• CAS Registry Number: 5631-00-5
• SMILES: [Ca].C2=C(NC(=O)C1=CC=CC=C1)C=CC(=C2O)C(O)=O.C4=C(NC(=O)C3=CC=CC=C3)C=CC(=C4O)C(O)=O.O.O.O.O.O
• InChI: 1S/2C14H11NO4.Ca.5H2O/c2*16-12-8-10(6-7-11(12)14(18)19)15-13(17)9-4-2-1-3-5-9;;;;;;/h2*1-8,16H,(H,15,17)(H,18,19);;5*1H2
• InChIKey: GDQBPYCBLYTKKS-UHFFFAOYSA-N

Properties

• Boiling point: 375.8°C at 760 mmHg (Cal.)
• Flash point: 181.1°C (Cal.)