Chemical Properties of Hexane, 2-nitro- (CAS 14255-44-8)

InChI

InChI=1S/C6H13NO2/c1-3-4-5-6(2)7(8)9/h6H,3-5H2,1-2H3

InChI Key

KNGSAYHEXMAZMM-UHFFFAOYSA-N

Formula

C6H13NO2

SMILES

CCCCC(C)[N+](=O)[O-]

Molecular Weight¹

131.17

CAS

14255-44-8

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[159.62; 375.64]	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			1.24300e+00
Coefficient B			6.79100e-01
Coefficient C			-3.84200e-04
Coefficient D			7.95000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	159.62	J/mol×K	273.00	Calculated Property
Cp,gas	196.93	J/mol×K	353.78	Calculated Property
Cp,gas	230.32	J/mol×K	434.56	Calculated Property
Cp,gas	260.05	J/mol×K	515.33	Calculated Property
Cp,gas	286.38	J/mol×K	596.11	Calculated Property
Cp,gas	309.54	J/mol×K	676.89	Calculated Property
Cp,gas	329.80	J/mol×K	757.67	Calculated Property
Cp,gas	347.40	J/mol×K	838.44	Calculated Property
Cp,gas	362.60	J/mol×K	919.22	Calculated Property
Cp,gas	375.64	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Hexane, 2-nitro-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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