Chemical Properties of Pentane, 3-iodo-3-methyl

InChI

InChI=1S/C6H13I/c1-4-6(3,7)5-2/h4-5H2,1-3H3

InChI Key

CIDZNASUPYMQCG-UHFFFAOYSA-N

Formula

C6H13I

SMILES

CCC(C)(I)CC

Molecular Weight¹

212.07

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	60.60	kJ/mol	Joback Calculated Property
ΔfH°gas	-99.05	kJ/mol	Joback Calculated Property
ΔfusH°	8.29	kJ/mol	Joback Calculated Property
ΔvapH°	37.03	kJ/mol	Joback Calculated Property
log10WS	-3.39		Crippen Calculated Property
logPoct/wat	3.000		Crippen Calculated Property
McVol	121.220	ml/mol	McGowan Calculated Property
Pc	3096.73	kPa	Joback Calculated Property
Inp	[958.00; 1023.00]
Inp	1023.00		NIST
Inp	958.00		NIST
I	1179.00		NIST
Tboil	426.59	K	Joback Calculated Property
Tc	640.95	K	Joback Calculated Property
Tfus	217.86	K	Joback Calculated Property
Vc	0.449	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[211.97; 275.05]	J/mol×K	[426.59; 640.95]
Cp,gas	211.97	J/mol×K	426.59	Joback Calculated Property
Cp,gas	224.35	J/mol×K	462.32	Joback Calculated Property
Cp,gas	235.92	J/mol×K	498.04	Joback Calculated Property
Cp,gas	246.73	J/mol×K	533.77	Joback Calculated Property
Cp,gas	256.82	J/mol×K	569.49	Joback Calculated Property
Cp,gas	266.25	J/mol×K	605.22	Joback Calculated Property
Cp,gas	275.05	J/mol×K	640.95	Joback Calculated Property
η	[0.0003828; 0.0104269]	Pa×s	[217.86; 426.59]
η	0.0104269	Pa×s	217.86	Joback Calculated Property
η	0.0041142	Pa×s	252.65	Joback Calculated Property
η	0.0020332	Pa×s	287.44	Joback Calculated Property
η	0.0011699	Pa×s	322.23	Joback Calculated Property
η	0.0007498	Pa×s	357.01	Joback Calculated Property
η	0.0005200	Pa×s	391.80	Joback Calculated Property
η	0.0003828	Pa×s	426.59	Joback Calculated Property

Similar Compounds

Find more compounds similar to Pentane, 3-iodo-3-methyl.

Sources

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

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