Methyl (2S)-3-[(1E)-13,13-Dibromotrideca-1,12-Dienyl]-2H-Azirine-2-Carboxylate
[CAS# 170554-75-3]

Identification

• Name: Methyl (2S)-3-[(1E)-13,13-Dibromotrideca-1,12-Dienyl]-2H-Azirine-2-Carboxylate
• Synonyms: (2S)-3-[(1E)-13,13-Dibromotrideca-1,12-Dienyl]-2H-Azirine-2-Carboxylic Acid Methyl Ester; Antazirine
• Molecular Formula: C₁₇H₂₅Br₂NO₂
• Molecular Weight: 435.20
• CAS Registry Number: 170554-75-3
• SMILES: [C@@H]1(N=C1\C=C\CCCCCCCCCC=C(Br)Br)C(OC)=O
• InChI: 1S/C17H25Br2NO2/c1-22-17(21)16-14(20-16)12-10-8-6-4-2-3-5-7-9-11-13-15(18)19/h10,12-13,16H,2-9,11H2,1H3/b12-10+/t16-/m0/s1
• InChIKey: KUIICVNFNJTIGS-TYZQSYOASA-N

Properties

• Density: 1.401g/cm³ (Cal.)
• Boiling point: 442.951°C at 760 mmHg (Cal.)
• Flash point: 221.689°C (Cal.)