Chemical Properties of Heptyl 4-nitrophenyl ether (CAS 13565-36-1)

InChI

InChI=1S/C13H19NO3/c1-2-3-4-5-6-11-17-13-9-7-12(8-10-13)14(15)16/h7-10H,2-6,11H2,1H3

InChI Key

AVDKYVSWJDZALX-UHFFFAOYSA-N

Formula

C13H19NO3

SMILES

CCCCCCCOc1ccc([N+](=O)[O-])cc1

Molecular Weight¹

237.29

CAS

13565-36-1

Other Names

• p-Heptyloxynitrobenzene
• p-n-Heptyloxynitrobenzene
• Benzene, 1-(heptyloxy)-4-nitro-
• p-Nitrophenyl heptyl ether

• 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_boilr : Boiling point at reduced pressure (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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[535.35; 613.04]	J/mol×K	[702.76; 921.69]
Cp,gas	535.35	J/mol×K	702.76	Joback Calculated Property
Cp,gas	550.68	J/mol×K	739.25	Joback Calculated Property
Cp,gas	565.01	J/mol×K	775.74	Joback Calculated Property
Cp,gas	578.38	J/mol×K	812.22	Joback Calculated Property
Cp,gas	590.82	J/mol×K	848.71	Joback Calculated Property
Cp,gas	602.36	J/mol×K	885.20	Joback Calculated Property
Cp,gas	613.04	J/mol×K	921.69	Joback Calculated Property

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to Heptyl 4-nitrophenyl ether.

Sources

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

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