Carbobenzoxycoumarin
[CAS# 93729-75-0]

Identification

• Name: Carbobenzoxycoumarin
• Synonyms: Phenylmethyl N-(2,7-Dihydroxy-8-Methyl-4-Oxo-Chromen-3-Yl)Carbamate; N-(2,7-Dihydroxy-8-Methyl-4-Oxo-3-Chromenyl)Carbamic Acid Phenylmethyl Ester; N-(2,7-Dihydroxy-4-Keto-8-Methyl-Chromen-3-Yl)Carbamic Acid Benzyl Ester
• Molecular Formula: C₁₈H₁₅NO₆
• Molecular Weight: 341.32
• CAS Registry Number: 93729-75-0
• SMILES: C1=CC(=C(C2=C1C(=O)C(=C(O2)O)NC(OCC3=CC=CC=C3)=O)C)O
• InChI: 1S/C18H15NO6/c1-10-13(20)8-7-12-15(21)14(17(22)25-16(10)12)19-18(23)24-9-11-5-3-2-4-6-11/h2-8,20,22H,9H2,1H3,(H,19,23)
• InChIKey: WNBRZUBKQZTERK-UHFFFAOYSA-N

Properties

• Density: 1.484g/cm³ (Cal.)
• Boiling point: 528.082°C at 760 mmHg (Cal.)
• Flash point: 273.174°C (Cal.)