Chemical Properties of 1-Cyclopentane carboxylic acid

InChI

InChI=1S/C6H8O2/c7-6(8)5-3-1-2-4-5/h3H,1-2,4H2,(H,7,8)

InChI Key

PYRZPBDTPRQYKG-UHFFFAOYSA-N

Formula

C6H8O2

SMILES

O=C(O)C1=CCCC1

Molecular Weight¹

112.13

Other Names

• 1-Cyclopentene-1-carboxylic acid
• 1-Cyclopentenecarboxylic acid
• Isoaleprolic acid

• 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).
• 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, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[106.97; 281.95]	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			-4.23100e+01
Coefficient B			6.67300e-01
Coefficient C			-4.78240e-04
Coefficient D			1.35200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	106.97	J/mol×K	273.00	Calculated Property
Cp,gas	139.90	J/mol×K	353.78	Calculated Property
Cp,gas	168.45	J/mol×K	434.56	Calculated Property
Cp,gas	193.07	J/mol×K	515.33	Calculated Property
Cp,gas	214.17	J/mol×K	596.11	Calculated Property
Cp,gas	232.19	J/mol×K	676.89	Calculated Property
Cp,gas	247.55	J/mol×K	757.67	Calculated Property
Cp,gas	260.68	J/mol×K	838.44	Calculated Property
Cp,gas	272.00	J/mol×K	919.22	Calculated Property
Cp,gas	281.95	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0008923; 0.0003340]	Pa×s	[392.15; 511.10]	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			-1.12444e+01
Coefficient B			1.65591e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			392.15
Temperature range, max.			511.10
η	0.0008923	Pa×s	392.15	Calculated Property
η	0.0007775	Pa×s	405.37	Calculated Property
η	0.0006834	Pa×s	418.58	Calculated Property
η	0.0006055	Pa×s	431.80	Calculated Property
η	0.0005403	Pa×s	445.02	Calculated Property
η	0.0004853	Pa×s	458.23	Calculated Property
η	0.0004386	Pa×s	471.45	Calculated Property
η	0.0003985	Pa×s	484.66	Calculated Property
η	0.0003640	Pa×s	497.88	Calculated Property
η	0.0003340	Pa×s	511.10	Calculated Property

Similar Compounds

Find more compounds similar to 1-Cyclopentane carboxylic acid.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• 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

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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