Chemical Properties of Cyclopenta(def)phenanthrenone (CAS 5737-13-3)

InChI

InChI=1S/C15H8O/c16-15-11-5-1-3-9-7-8-10-4-2-6-12(15)14(10)13(9)11/h1-8H

InChI Key

IFCBMPOMNSORDG-UHFFFAOYSA-N

Formula

C15H18O

SMILES

O=c1c2cccc3ccc4cccc1c4c32

Molecular Weight¹

214.30

CAS

5737-13-3

Other Names

• 4H-cyclopenta[def]phenathren-4-one
• 4H-cyclopenta[def]phenanthren-4-one

• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-5.14		Crippen Calculated Property
logPoct/wat	3.382		Crippen Calculated Property
McVol	150.240	ml/mol	McGowan Calculated Property
Inp	[341.20; 1977.00]
Inp	1977.00		NIST
Inp	342.90		NIST
Inp	341.20		NIST

Temperature Dependent Properties

Similar Compounds

Find more compounds similar to Cyclopenta(def)phenanthrenone.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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