Chemical Properties of Hexane, 1,1-dichloro

InChI

InChI=1S/C6H12Cl2/c1-2-3-4-5-6(7)8/h6H,2-5H2,1H3

InChI Key

RQXXCWHCUOJQGR-UHFFFAOYSA-N

Formula

C6H12Cl2

SMILES

CCCCCC(Cl)Cl

Molecular Weight¹

155.06

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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.
• 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
ω	0.3723		Relay (1.0) Calculated Property
ΔfG°	-26.66	kJ/mol	Joback Calculated Property
ΔfH°gas	-200.95	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	16.17	kJ/mol	Joback Calculated Property
ΔvapH°	48.41	kJ/mol	Relay (1.0) Calculated Property
IE	10.54	eV	Relay (1.0) Calculated Property
log10WS	-3.74		Relay (1.0) Calculated Property
logPoct/wat	3.370		Crippen Calculated Property
McVol	119.880	ml/mol	McGowan Calculated Property
Pc	2890.51	kPa	Joback Calculated Property
Inp	[976.00; 976.00]
Inp	976.00		NIST
Inp	976.00		NIST
Tboil	433.94	K	Relay (1.0) Calculated Property
Tc	622.57	K	Relay (1.0) Calculated Property
Tfus	191.00	K	Relay (1.0) Calculated Property
Vc	0.454	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[159.26; 345.95]	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			2.15340e+01
Coefficient B			5.93320e-01
Coefficient C			-3.46600e-04
Coefficient D			7.77000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	159.26	J/mol×K	273.00	Calculated Property
Cp,gas	191.50	J/mol×K	353.78	Calculated Property
Cp,gas	220.29	J/mol×K	434.56	Calculated Property
Cp,gas	245.88	J/mol×K	515.33	Calculated Property
Cp,gas	268.51	J/mol×K	596.11	Calculated Property
Cp,gas	288.44	J/mol×K	676.89	Calculated Property
Cp,gas	305.90	J/mol×K	757.67	Calculated Property
Cp,gas	321.14	J/mol×K	838.44	Calculated Property
Cp,gas	334.41	J/mol×K	919.22	Calculated Property
Cp,gas	345.95	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0074186; 0.0003029]	Pa×s	[202.22; 416.96]	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			-1.11141e+01
Coefficient B			1.25586e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			202.22
Temperature range, max.			416.96
η	0.0074186	Pa×s	202.22	Calculated Property
η	0.0038519	Pa×s	226.08	Calculated Property
η	0.0022666	Pa×s	249.94	Calculated Property
η	0.0014629	Pa×s	273.80	Calculated Property
η	0.0010128	Pa×s	297.66	Calculated Property
η	0.0007405	Pa×s	321.52	Calculated Property
η	0.0005654	Pa×s	345.38	Calculated Property
η	0.0004470	Pa×s	369.24	Calculated Property
η	0.0003636	Pa×s	393.10	Calculated Property
η	0.0003029	Pa×s	416.96	Calculated Property

Similar Compounds

Find more compounds similar to Hexane, 1,1-dichloro.

Sources

• Cheméo Relay (1.0)
• 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.