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Aflatoxin B1 Dichloride
[CAS# 58209-98-6]

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CAS#: 58209-98-6
Product: Aflatoxin B1 Dichloride
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Identification
Name Aflatoxin B1 Dichloride
Synonyms Aflatoxin B1 2,3-Dichloride; Aflatoxin B1 Dichloride; Aflatoxin B1-2,3-Dichloride
Molecular Structure CAS#: 58209-98-6, Aflatoxin B1 Dichloride
Molecular Formula C17H12Cl2O6
Molecular Weight 383.18
CAS Registry Number 58209-98-6
SMILES [C@@H]15[C@@H](OC2=C1C3=C(C(=C2)OC)C4=C(C(O3)=O)C(=O)CC4)O[C@@H](Cl)[C@@H]5Cl
InChI 1S/C17H12Cl2O6/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/h4,12-13,15,17H,2-3H2,1H3/t12-,13-,15-,17+/m1/s1
InChIKey SHIWCSLVBGROOU-SMKXDYDZSA-N
Properties
Density 1.665g/cm3 (Cal.)
Boiling point 588.121°C at 760 mmHg (Cal.)
Flash point 240.299°C (Cal.)
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List of Reports Available for Aflatoxin B1 Dichloride
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