Sodium 7-[[1-(3-Bromophenyl)Cyclopentanecarbonyl]Amino]-3-Methyl-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate
[CAS# 143407-74-3]

Identification

• Name: Sodium 7-[[1-(3-Bromophenyl)Cyclopentanecarbonyl]Amino]-3-Methyl-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate
• Synonyms: Sodium 7-[[[1-(3-Bromophenyl)Cyclopentyl]-Oxomethyl]Amino]-3-Methyl-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate; Sodium 7-[[1-(3-Bromophenyl)Cyclopentanecarbonyl]Amino]-8-Keto-3-Methyl-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate; Sodium 7-[[1-(3-Bromophenyl)Cyclopentyl]Carbonylamino]-3-Methyl-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate
• Molecular Formula: C₂₀H₂₀BrN₂NaO₄S
• Molecular Weight: 487.34
• CAS Registry Number: 143407-74-3
• SMILES: C1=C(Br)C=CC=C1C4(C(=O)NC3C2SCC(=C(N2C3=O)C([O-])=O)C)CCCC4.[Na+]
• InChI: 1S/C20H21BrN2O4S.Na/c1-11-10-28-17-14(16(24)23(17)15(11)18(25)26)22-19(27)20(7-2-3-8-20)12-5-4-6-13(21)9-12;/h4-6,9,14,17H,2-3,7-8,10H2,1H3,(H,22,27)(H,25,26);/q;+1/p-1
• InChIKey: FVINXAYFQRVTCA-UHFFFAOYSA-M

Properties

• Boiling point: 755.8°C at 760 mmHg (Cal.)
• Flash point: 410.9°C (Cal.)