3-[(3-Methoxyphenyl)Carbamoyl]Bicyclo[2.2.1]Hept-5-Ene-2-Carboxylic Acid
[CAS# 464877-92-7]

Identification

• Name: 3-[(3-Methoxyphenyl)Carbamoyl]Bicyclo[2.2.1]Hept-5-Ene-2-Carboxylic Acid
• Synonyms: 3-(3-Methoxy-phenylcarbamoyl)-bicyclo[2.2.1]hept-5-ene-2-carboxylic acid; 3-[N-(3-methoxyphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid; BAS 00629365
• Molecular Formula: C₁₆H₁₇NO₄
• Molecular Weight: 287.31
• CAS Registry Number: 464877-92-7
• SMILES: COC1=CC=CC(=C1)NC(=O)C2C3CC(C2C(=O)O)C=C3
• InChI: 1S/C16H17NO4/c1-21-12-4-2-3-11(8-12)17-15(18)13-9-5-6-10(7-9)14(13)16(19)20/h2-6,8-10,13-14H,7H2,1H3,(H,17,18)(H,19,20)
• InChIKey: BIZXJOLLOODDNH-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 551.4±50.0°C at 760 mmHg (Cal.)
• Flash point: 287.3±30.1°C (Cal.)
• Refractive index: 1.636 (Cal.)