Brovanexine
[CAS# 54340-61-3]

Identification

• Name: Brovanexine
• Synonyms: [2-[(4-Acetoxy-3-Methoxy-Benzoyl)Amino]-3,5-Dibromo-Phenyl]Methyl-(Cyclohexylmethyl)Ammonium Chloride; [2-[[(4-Acetoxy-3-Methoxyphenyl)-Oxomethyl]Amino]-3,5-Dibromophenyl]Methyl-(Cyclohexylmethyl)Ammonium Chloride; [2-[(4-Acetoxy-3-Methoxy-Benzoyl)Amino]-3,5-Dibromo-Benzyl]-(Cyclohexylmethyl)Ammonium Chloride
• Molecular Formula: C₂₄H₂₉Br₂ClN₂O₄
• Molecular Weight: 604.77
• CAS Registry Number: 54340-61-3
• SMILES: C1=C(C(=C(C=C1Br)Br)NC(C2=CC(=C(C=C2)OC(C)=O)OC)=O)C[NH2+]CC3CCCCC3.[Cl-]
• InChI: 1S/C24H28Br2N2O4.ClH/c1-15(29)32-21-9-8-17(11-22(21)31-2)24(30)28-23-18(10-19(25)12-20(23)26)14-27-13-16-6-4-3-5-7-16;/h8-12,16,27H,3-7,13-14H2,1-2H3,(H,28,30);1H
• InChIKey: BXIKNLCWBPKQLJ-UHFFFAOYSA-N

Properties

• Boiling point: 558.2°C at 760 mmHg (Cal.)
• Flash point: 291.4°C (Cal.)