7,8-dihydrobenzo[a]pyrene-7,8-diol

CAS: 13345-25-0

Molecular Formula	`C20H14O2`
Molecular Weight	286.3 g/mol
LogP	3.9
Topological Polar Surface Area	40.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	2
Rotatable Bonds	0
Exact Mass	286.09937
Heavy Atoms	22
Complexity	472.0

Chemical Identifiers

CAS Number	13345-25-0
SMILES	`C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C=CC(C5O)O)C=C2`
InChIKey	`YDXRLMMGARHIIC-UHFFFAOYSA-N`

📖 Product Overview

7,8-dihydrobenzo[a]pyrene-7,8-diol (CAS: 13345-25-0) is a chemical compound with molecular formula C20H14O2 and molecular weight 286.3 g/mol. Its IUPAC systematic name is 7,8-dihydrobenzo[a]pyrene-7,8-diol. LogP 3.9 Topological Polar Surface Area 40.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 2 Rotatable Bonds 0 Exact Mass 286.09937 Heavy Atoms 22 Complexity 472.0 InChI Key: YDXRLMMGARHIIC-UHFFFAOYSA-N. SMILES: C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C=CC(C5O)O)C=C2.

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