N,N'-1,4-Butanediylbis(7,9-Dibromo-10-Hydroxy-8-Methoxy-1-Oxa-2-Azaspiro[4.5]Deca-2,6,8-Triene-3-Carboxamide)
[CAS# 28714-26-3]

Identification

• Name: N,N'-1,4-Butanediylbis(7,9-Dibromo-10-Hydroxy-8-Methoxy-1-Oxa-2-Azaspiro[4.5]Deca-2,6,8-Triene-3-Carboxamide)
• Synonyms: aerothionin; NCI60_001482; NSC177380
• Molecular Formula: C₂₄H₂₆Br₄N₄O₈
• Molecular Weight: 818.10
• CAS Registry Number: 28714-26-3
• SMILES: COC1=C(C(C2(CC(=NO2)C(=O)NCCCCNC(=O)C3=NOC4(C3)C=C(C(=C(C4O)Br)OC)Br)C=C1Br)O)Br
• InChI: 1S/C24H26Br4N4O8/c1-37-17-11(25)7-23(19(33)15(17)27)9-13(31-39-23)21(35)29-5-3-4-6-30-22(36)14-10-24(40-32-14)8-12(26)18(38-2)16(28)20(24)34/h7-8,19-20,33-34H,3-6,9-10H2,1-2H3,(H,29,35)(H,30,36)
• InChIKey: BJWQSQOWGBUSFC-UHFFFAOYSA-N

Properties

• Density: 2.1±0.1g/cm³ (Cal.)
• Refractive index: 1.709 (Cal.)