Chemical Properties of Cyclopentanecarboxylic acid, 3-(chloroformyl)-, methyl ester, cis-

InChI

InChI=1S/C8H11ClO3/c1-12-8(11)6-3-2-5(4-6)7(9)10/h5-6H,2-4H2,1H3

InChI Key

TYWZGOWRMWCWFP-UHFFFAOYSA-N

Formula

C8H11ClO3

SMILES

COC(=O)C1CCC(C(=O)Cl)C1

Molecular Weight¹

190.63

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, 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	[174.90; 427.41]	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			-1.32700e+01
Coefficient B			7.93020e-01
Coefficient C			-3.90500e-04
Coefficient D			3.81600e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	174.90	J/mol×K	273.00	Calculated Property
Cp,gas	220.10	J/mol×K	353.78	Calculated Property
Cp,gas	260.73	J/mol×K	434.56	Calculated Property
Cp,gas	296.92	J/mol×K	515.33	Calculated Property
Cp,gas	328.78	J/mol×K	596.11	Calculated Property
Cp,gas	356.43	J/mol×K	676.89	Calculated Property
Cp,gas	380.00	J/mol×K	757.67	Calculated Property
Cp,gas	399.61	J/mol×K	838.44	Calculated Property
Cp,gas	415.37	J/mol×K	919.22	Calculated Property
Cp,gas	427.41	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0032669; 0.0004092]	Pa×s	[308.76; 530.59]	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			-1.06927e+01
Coefficient B			1.53416e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			308.76
Temperature range, max.			530.59
η	0.0032669	Pa×s	308.76	Calculated Property
η	0.0022626	Pa×s	333.41	Calculated Property
η	0.0016483	Pa×s	358.06	Calculated Property
η	0.0012508	Pa×s	382.70	Calculated Property
η	0.0009814	Pa×s	407.35	Calculated Property
η	0.0007916	Pa×s	432.00	Calculated Property
η	0.0006536	Pa×s	456.65	Calculated Property
η	0.0005503	Pa×s	481.30	Calculated Property
η	0.0004711	Pa×s	505.95	Calculated Property
η	0.0004092	Pa×s	530.59	Calculated Property

Similar Compounds

Find more compounds similar to Cyclopentanecarboxylic acid, 3-(chloroformyl)-, methyl ester, cis-.

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

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