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Peroxyhypocrellin
[CAS# 80047-67-2]

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CAS#: 80047-67-2
Product: Peroxyhypocrellin
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Identification
Name Peroxyhypocrellin
Synonyms Peroxyhypocrellin
Molecular Structure CAS#: 80047-67-2, Peroxyhypocrellin
Molecular Formula C30H28O12
Molecular Weight 580.54
CAS Registry Number 80047-67-2
SMILES CC1(O)C37OOC1C2=C(OC)C(=O)C(O)C5=C4C2C3=C(C6=C4C(C(=C5)OC)C(=CC6=O)OC)C(=C(OC)C7C(=O)C)O
InChI 1S/C30H28O12/c1-9(31)21-27(40-6)24(34)19-15-11(32)8-13(38-4)16-12(37-3)7-10-14(17(15)16)18-20(26(39-5)25(35)23(10)33)28-29(2,36)30(21,22(18)19)42-41-28/h7-8,16,18,21,23,28,33-34,36H,1-6H3
InChIKey IJDYTMZCLRHIPL-UHFFFAOYSA-N
Properties
Density 1.608g/cm3 (Cal.)
Boiling point 973.275°C at 760 mmHg (Cal.)
Flash point 324.302°C (Cal.)
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