7-Amino-3-Methyl-8-Oxo-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid
[CAS# 183510-01-2]

Identification

• Name: 7-Amino-3-Methyl-8-Oxo-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid
• Synonyms: 1-AZABICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLICACID, 7-AMINO-3-METHYL-8-OXO-, (6R-TRANS)- (9CI); 7-amino-3-methyl-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
• Molecular Formula: C₉H₁₂N₂O₃
• Molecular Weight: 196.20
• CAS Registry Number: 183510-01-2
• SMILES: CC1=C(N2C(CC1)C(C2=O)N)C(=O)O
• InChI: 1S/C9H12N2O3/c1-4-2-3-5-6(10)8(12)11(5)7(4)9(13)14/h5-6H,2-3,10H2,1H3,(H,13,14)
• InChIKey: TTXYGZPFNFVSFJ-UHFFFAOYSA-N

Properties

• Density: 1.438g/cm³ (Cal.)
• Boiling point: 449.183°C at 760 mmHg (Cal.)
• Flash point: 225.458°C (Cal.)
• Refractive index: 1.626 (Cal.)