(6S,7R)-7-Methoxy-3-methyl-8-oxo-1-azabicyclo[4.2.0]octa-2,4-diene-2-carboxylic acid
[CAS# 779990-38-4]

Identification

• Name: (6S,7R)-7-Methoxy-3-methyl-8-oxo-1-azabicyclo[4.2.0]octa-2,4-diene-2-carboxylic acid
• Synonyms: (6S,7R)-7-methoxy-3-methyl-8-oxo-1-azabicyclo[4.2.0]octa-2,4-diene-2-carboxylic acid
• Molecular Formula: C₁₀H₁₁NO₄
• Molecular Weight: 209.20
• CAS Registry Number: 779990-38-4
• SMILES: CC1=C(N2[C@@H](C=C1)[C@H](C2=O)OC)C(=O)O
• InChI: 1S/C10H11NO4/c1-5-3-4-6-8(15-2)9(12)11(6)7(5)10(13)14/h3-4,6,8H,1-2H3,(H,13,14)/t6-,8+/m0/s1
• InChIKey: AFRAGLLHWHNWMY-POYBYMJQSA-N

Properties

• Density: 1.407g/cm³ (Cal.)
• Boiling point: 439.643°C at 760 mmHg (Cal.)
• Flash point: 219.688°C (Cal.)
• Refractive index: 1.602 (Cal.)