Chemical Properties of Glutaric acid, cyclohexylmethyl 1-naphthyl ester

InChI

InChI=1S/C22H26O4/c23-21(25-16-17-8-2-1-3-9-17)14-7-15-22(24)26-20-13-6-11-18-10-4-5-12-19(18)20/h4-6,10-13,17H,1-3,7-9,14-16H2

InChI Key

FWCVAQBMXYONRQ-UHFFFAOYSA-N

Formula

C22H26O4

SMILES

O=C(CCCC(=O)Oc1cccc2ccccc12)OCC1CCCCC1

Molecular Weight¹

354.45

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion 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).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	43.98	kJ/mol	Joback Calculated Property
IE	7.91	eV	Relay (1.0) Calculated Property
log10WS	-5.18		Relay (1.0) Calculated Property
logPoct/wat	5.039		Crippen Calculated Property
McVol	281.640	ml/mol	McGowan Calculated Property
Inp	[3018.00; 3018.00]
Inp	3018.00		NIST
Inp	3018.00		NIST
Tfus	327.90	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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	[902.20; 974.46]	J/mol×K	[889.59; 1119.20]
Cp,gas	902.20	J/mol×K	889.59	Joback Calculated Property
Cp,gas	917.88	J/mol×K	927.86	Joback Calculated Property
Cp,gas	932.01	J/mol×K	966.13	Joback Calculated Property
Cp,gas	944.65	J/mol×K	1004.40	Joback Calculated Property
Cp,gas	955.89	J/mol×K	1042.66	Joback Calculated Property
Cp,gas	965.80	J/mol×K	1080.93	Joback Calculated Property
Cp,gas	974.46	J/mol×K	1119.20	Joback Calculated Property
η	[0.0000652; 0.0008655]	Pa×s	[501.38; 889.59]
η	0.0008655	Pa×s	501.38	Joback Calculated Property
η	0.0004397	Pa×s	566.08	Joback Calculated Property
η	0.0002567	Pa×s	630.78	Joback Calculated Property
η	0.0001656	Pa×s	695.48	Joback Calculated Property
η	0.0001152	Pa×s	760.19	Joback Calculated Property
η	0.0000848	Pa×s	824.89	Joback Calculated Property
η	0.0000652	Pa×s	889.59	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, cyclohexylmethyl 1-naphthyl ester.

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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