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Benzo(a)Pyrene-7,8-Diol
[CAS# 57303-99-8]

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CAS#: 57303-99-8
Product: Benzo(a)Pyrene-7,8-Diol
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Identification
Name Benzo(a)Pyrene-7,8-Diol
Synonyms 7,8-Dihydroxybenzo(A)Pyrene
Molecular Structure CAS#: 57303-99-8, Benzo(a)Pyrene-7,8-Diol
Molecular Formula C20H12O2
Molecular Weight 284.31
CAS Registry Number 57303-99-8
SMILES C1=C5C3=C(C2=CC=C(C(=C12)O)O)C=CC4=CC=CC(=C34)C=C5
InChI 1S/C20H12O2/c21-17-9-8-14-15-7-6-12-3-1-2-11-4-5-13(19(15)18(11)12)10-16(14)20(17)22/h1-10,21-22H
InChIKey FWKXMJCJEOUXDE-UHFFFAOYSA-N
Properties
Density 1.473g/cm3 (Cal.)
Boiling point 572.259°C at 760 mmHg (Cal.)
Flash point 279.255°C (Cal.)
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