Aflatoxin B1-8,9-Dichloride
[CAS# 119718-03-5]

Identification

• Name: Aflatoxin B1-8,9-Dichloride
• Synonyms: Afb1cl2; Aflatoxin B1-8,9-Dichloride; Aflatoxin-B1-8,9-Dichloride
• Molecular Formula: C₁₇H₁₀Cl₂O₆
• Molecular Weight: 381.17
• CAS Registry Number: 119718-03-5
• SMILES: [C@@H]15[C@@H](OC2=CC(=C3C(=C12)OC(=O)C4=C3CCC4=O)OC)OC(=C5Cl)Cl
• InChI: 1S/C17H10Cl2O6/c1-22-7-4-8-11(12-13(18)15(19)25-17(12)23-8)14-10(7)5-2-3-6(20)9(5)16(21)24-14/h4,12,17H,2-3H2,1H3/t12-,17+/m1/s1
• InChIKey: TWAYMZIMOFMBAE-PXAZEXFGSA-N

Properties

• Density: 1.717g/cm³ (Cal.)
• Boiling point: 553.715°C at 760 mmHg (Cal.)
• Flash point: 225.892°C (Cal.)