3-[(2-Aminoethenyl)thio]-6-(1-hydroxyethyl)-7-oxo-1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
[CAS# 64761-66-6]

Identification

• Name: 3-[(2-Aminoethenyl)thio]-6-(1-hydroxyethyl)-7-oxo-1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
• Synonyms: 3-[(E)-2-Aminovinyl]Sulfanyl-6-(1-Hydroxyethyl)-7-Oxo-1-Azabicyclo[3.2.0]Hept-2-Ene-2-Carboxylic Acid; 3-[[(E)-2-Aminovinyl]Thio]-6-(1-Hydroxyethyl)-7-Oxo-1-Azabicyclo[3.2.0]Hept-2-Ene-2-Carboxylic Acid; 3-[[(E)-2-Aminovinyl]Thio]-6-(1-Hydroxyethyl)-7-Keto-1-Azabicyclo[3.2.0]Hept-2-Ene-2-Carboxylic Acid
• Molecular Formula: C₁₁H₁₄N₂O₄S
• Molecular Weight: 270.30
• CAS Registry Number: 64761-66-6
• SMILES: CC(O)C1C2N(C1=O)C(=C(S\C=C\N)C2)C(=O)O
• InChI: 1S/C11H14N2O4S/c1-5(14)8-6-4-7(18-3-2-12)9(11(16)17)13(6)10(8)15/h2-3,5-6,8,14H,4,12H2,1H3,(H,16,17)/b3-2+
• InChIKey: HFTVKHFILHLXJF-NSCUHMNNSA-N

Properties

• Density: 1.549g/cm³ (Cal.)
• Boiling point: 502.799°C at 760 mmHg (Cal.)
• Flash point: 257.884°C (Cal.)