4-Chloro-1-[(O-ethyl-3-oxoseryl)amino]-2-(2-fluorobenzoyl)benzene hydrobromide (1:1)
[CAS# 77822-80-1]

Identification

• Name: 4-Chloro-1-[(O-ethyl-3-oxoseryl)amino]-2-(2-fluorobenzoyl)benzene hydrobromide (1:1)
• Synonyms: ethyl 3-[[4-chloro-2-(2-fluorobenzoyl)phenyl]amino]-3-oxo-alaninate monohydrobromide
• Molecular Formula: C₁₈H₁₇BrClFN₂O₄
• Molecular Weight: 459.69
• CAS Registry Number: 77822-80-1
• EINECS: 278-774-6
• SMILES: Br.Clc1cc(c(NC(=O)C(N)C(=O)OCC)cc1)C(=O)c2ccccc2F
• InChI: 1S/C18H16ClFN2O4.BrH/c1-2-26-18(25)15(21)17(24)22-14-8-7-10(19)9-12(14)16(23)11-5-3-4-6-13(11)20;/h3-9,15H,2,21H2,1H3,(H,22,24);1H
• InChIKey: RCYVAMQWTAQUAZ-UHFFFAOYSA-N

Properties

• Boiling point: 624.1°C at 760 mmHg (Cal.)
• Flash point: 331.3°C (Cal.)