Chemical Properties of p-Nitrophenyl hexadecyl ether (CAS 102703-33-3)

InChI

InChI=1S/C22H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-26-22-18-16-21(17-19-22)23(24)25/h16-19H,2-15,20H2,1H3

InChI Key

HOBVESXNPYPANG-UHFFFAOYSA-N

Formula

C22H37NO3

SMILES

CCCCCCCCCCCCCCCCOc1ccc([N+](=O)[O-])cc1

Molecular Weight¹

363.53

CAS

102703-33-3

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1054.16; 1142.34]	J/mol×K	[908.68; 1117.91]
Cp,gas	1054.16	J/mol×K	908.68	Joback Calculated Property
Cp,gas	1071.67	J/mol×K	943.55	Joback Calculated Property
Cp,gas	1087.98	J/mol×K	978.42	Joback Calculated Property
Cp,gas	1103.15	J/mol×K	1013.30	Joback Calculated Property
Cp,gas	1117.22	J/mol×K	1048.17	Joback Calculated Property
Cp,gas	1130.27	J/mol×K	1083.04	Joback Calculated Property
Cp,gas	1142.34	J/mol×K	1117.91	Joback Calculated Property

Similar Compounds

Find more compounds similar to p-Nitrophenyl hexadecyl ether.

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

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.
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