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1-hydroxypyrene

1-hydroxypyrene

CAS: 5315-79-7

Formula: C16H10O

SMILES: OC1=CC=C2C=CC3=CC=CC4=C3C2=C1C=C4

IUPAC: pyren-1-ol

InChI: InChI=1S/C16H10O/c17-14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9,17H

Composition: C (88.05%), H (4.62%), O (7.33%)

Molar Mass: 218.255

Atom Count: 27

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 218.073164942
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey BIJNHUAPTJVVNQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.7
Topological Polar Surface Area 20.23
Polarizability 30.43
Ring Count 4
Rotatable Bond Count 0

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