Diphenylmethyl (6R-trans)-3-Methoxy-8-Oxo-7-(Phenoxyacetamido)-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate
[CAS# 54639-52-0]

Identification

• Name: Diphenylmethyl (6R-trans)-3-Methoxy-8-Oxo-7-(Phenoxyacetamido)-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate
• Synonyms: (6R,7R)-3-Methoxy-8-Oxo-7-[[1-Oxo-2-(Phenoxy)Ethyl]Amino]-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid Di(Phenyl)Methyl Ester; (6R,7R)-8-Keto-3-Methoxy-7-[[2-(Phenoxy)Acetyl]Amino]-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid Di(Phenyl)Methyl Ester; Di(Phenyl)Methyl (6R,7R)-3-Methoxy-8-Oxo-7-[2-(Phenoxy)Ethanoylamino]-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate
• Molecular Formula: C₂₉H₂₆N₂O₆S
• Molecular Weight: 530.59
• CAS Registry Number: 54639-52-0
• EINECS: 259-267-9
• SMILES: [C@@H]14N(C(=C(CS1)OC)C(OC(C2=CC=CC=C2)C3=CC=CC=C3)=O)C([C@H]4NC(=O)COC5=CC=CC=C5)=O
• InChI: 1S/C29H26N2O6S/c1-35-22-18-38-28-24(30-23(32)17-36-21-15-9-4-10-16-21)27(33)31(28)25(22)29(34)37-26(19-11-5-2-6-12-19)20-13-7-3-8-14-20/h2-16,24,26,28H,17-18H2,1H3,(H,30,32)/t24-,28-/m1/s1
• InChIKey: QLVVZQVGFLLLLB-UFHPHHKVSA-N

Properties

• Density: 1.39g/cm³ (Cal.)
• Boiling point: 811.153°C at 760 mmHg (Cal.)
• Flash point: 444.37°C (Cal.)