Chemical Properties of (3-Iodophenyl) methanol, ethyl ether

InChI

InChI=1S/C9H11IO/c1-2-11-7-8-4-3-5-9(10)6-8/h3-6H,2,7H2,1H3

InChI Key

OSYGCJIBBWLFOG-UHFFFAOYSA-N

Formula

C9H11IO

SMILES

CCOCc1cccc(I)c1

Molecular Weight¹

262.09

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• 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_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-49.04	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	18.31	kJ/mol	Joback Calculated Property
ΔvapH°	65.30	kJ/mol	Relay (1.0) Calculated Property
IE	8.40	eV	Relay (1.0) Calculated Property
logPoct/wat	2.828		Crippen Calculated Property
McVol	145.600	ml/mol	McGowan Calculated Property
Inp	[1458.00; 1458.00]
Inp	1458.00		NIST
Inp	1458.00		NIST
Tboil	528.21	K	Relay (1.0) Calculated Property
Tfus	232.01	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[288.52; 353.17]	J/mol×K	[552.54; 792.32]
Cp,gas	288.52	J/mol×K	552.54	Joback Calculated Property
Cp,gas	301.23	J/mol×K	592.50	Joback Calculated Property
Cp,gas	313.12	J/mol×K	632.47	Joback Calculated Property
Cp,gas	324.23	J/mol×K	672.43	Joback Calculated Property
Cp,gas	334.59	J/mol×K	712.40	Joback Calculated Property
Cp,gas	344.23	J/mol×K	752.36	Joback Calculated Property
Cp,gas	353.17	J/mol×K	792.32	Joback Calculated Property
η	[0.0002211; 0.0021690]	Pa×s	[310.42; 552.54]
η	0.0021690	Pa×s	310.42	Joback Calculated Property
η	0.0011910	Pa×s	350.77	Joback Calculated Property
η	0.0007401	Pa×s	391.13	Joback Calculated Property
η	0.0005027	Pa×s	431.48	Joback Calculated Property
η	0.0003648	Pa×s	471.83	Joback Calculated Property
η	0.0002785	Pa×s	512.19	Joback Calculated Property
η	0.0002211	Pa×s	552.54	Joback Calculated Property

Similar Compounds

Find more compounds similar to (3-Iodophenyl) methanol, ethyl ether.

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
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.