Chemical Properties of iodo(2H3)methane (CAS 865-50-9)

InChI

InChI=1S/CH3I/c1-2/h1H3/i1D3

InChI Key

INQOMBQAUSQDDS-FIBGUPNXSA-N

Formula

CH3I

SMILES

[2H]C([2H])([2H])I

Molecular Weight¹

144.96

CAS

865-50-9

Other Names

• iodomethane-d3

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[43.77; 80.09]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.36700e+01
Coefficient B			1.37820e-01
Coefficient C			-1.12000e-04
Coefficient D			4.06000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	43.77	J/mol×K	273.00	Calculated Property
Cp,gas	50.21	J/mol×K	353.78	Calculated Property
Cp,gas	55.74	J/mol×K	434.56	Calculated Property
Cp,gas	60.51	J/mol×K	515.33	Calculated Property
Cp,gas	64.63	J/mol×K	596.11	Calculated Property
Cp,gas	68.23	J/mol×K	676.89	Calculated Property
Cp,gas	71.46	J/mol×K	757.67	Calculated Property
Cp,gas	74.42	J/mol×K	838.44	Calculated Property
Cp,gas	77.26	J/mol×K	919.22	Calculated Property
Cp,gas	80.09	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0045562; 0.0003061]	Pa×s	[159.09; 365.95]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.01686e+01
Coefficient B			7.60020e+02
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			159.09
Temperature range, max.			365.95
η	0.0045562	Pa×s	159.09	Calculated Property
η	0.0024929	Pa×s	182.07	Calculated Property
η	0.0015614	Pa×s	205.06	Calculated Property
η	0.0010747	Pa×s	228.04	Calculated Property
η	0.0007920	Pa×s	251.03	Calculated Property
η	0.0006144	Pa×s	274.01	Calculated Property
η	0.0004957	Pa×s	296.99	Calculated Property
η	0.0004125	Pa×s	319.98	Calculated Property
η	0.0003518	Pa×s	342.96	Calculated Property
η	0.0003061	Pa×s	365.95	Calculated Property

Similar Compounds

Find more compounds similar to iodo(2H3)methane.

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

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