Chemical Properties of 3,6-Dimethoxy-4,5-epoxyphenanthrene

InChI

InChI=1S/C16H12O3/c1-17-11-7-5-9-3-4-10-6-8-12(18-2)16-14(10)13(9)15(11)19-16/h3-8H,1-2H3

InChI Key

YHUFSDUFQNOMKL-UHFFFAOYSA-N

Formula

C16H12O3

SMILES

COc1ccc2ccc3ccc(OC)c4oc1c2c34

Molecular Weight¹

252.26

• 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	-10.27		Crippen Calculated Property
logPoct/wat	4.194		Crippen Calculated Property
McVol	180.370	ml/mol	McGowan Calculated Property
Inp	[2333.00; 2333.00]
Inp	2333.00		NIST
Inp	2333.00		NIST

Similar Compounds

Find more compounds similar to 3,6-Dimethoxy-4,5-epoxyphenanthrene.

Sources

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

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