Chemical Properties of Furan, 2,2'-methylenebis[5-methyl-

InChI

InChI=1S/C11H12O2/c1-8-3-5-10(12-8)7-11-6-4-9(2)13-11/h3-6H,7H2,1-2H3

InChI Key

FVKCJDISKKFSJI-UHFFFAOYSA-N

Formula

C11H12O2

SMILES

Cc1ccc(Cc2ccc(C)o2)o1

Molecular Weight¹

176.22

Other Names

• Furan, 2,2'-methylenebis*5-methyl-

• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔvapH°	65.40	kJ/mol	Relay (1.0) Calculated Property
IE	8.07	eV	Relay (1.0) Calculated Property
logPoct/wat	3.080		Crippen Calculated Property
McVol	138.670	ml/mol	McGowan Calculated Property
I	[1729.00; 1732.00]
I	1729.00		NIST
I	1731.00		NIST
I	1731.00		NIST
I	1732.00		NIST
I	1732.00		NIST
I	1729.00		NIST
Tboil	520.49	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to Furan, 2,2'-methylenebis[5-methyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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