Chemical Properties of 7-decen-5-olide (CAS 25524-96-3)

InChI

InChI=1S/C10H16O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h3-4,9H,2,5-8H2,1H3/b4-3+

InChI Key

XPPALVZZCMPTIV-ONEGZZNKSA-N

Formula

C10H16O2

SMILES

CCC=CCC1CCCC(=O)O1

Molecular Weight¹

168.23

CAS

25524-96-3

• 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).
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-447.12	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	22.26	kJ/mol	Joback Calculated Property
ΔvapH°	72.71	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	2.438		Crippen Calculated Property
McVol	144.040	ml/mol	McGowan Calculated Property
I	[2245.00; 2252.00]
I	2252.00		NIST
I	2245.00		NIST
I	2252.00		NIST
Tboil	564.25	K	Relay (1.0) Calculated Property

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	[191.62; 494.28]	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			-5.03380e+01
Coefficient B			1.06032e+00
Coefficient C			-6.83200e-04
Coefficient D			1.67500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	191.62	J/mol×K	273.00	Calculated Property
Cp,gas	246.69	J/mol×K	353.78	Calculated Property
Cp,gas	295.16	J/mol×K	434.56	Calculated Property
Cp,gas	337.57	J/mol×K	515.33	Calculated Property
Cp,gas	374.44	J/mol×K	596.11	Calculated Property
Cp,gas	406.30	J/mol×K	676.89	Calculated Property
Cp,gas	433.69	J/mol×K	757.67	Calculated Property
Cp,gas	457.13	J/mol×K	838.44	Calculated Property
Cp,gas	477.15	J/mol×K	919.22	Calculated Property
Cp,gas	494.28	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0036610; 0.0003042]	Pa×s	[254.13; 489.28]	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			-1.07866e+01
Coefficient B			1.31553e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			254.13
Temperature range, max.			489.28
η	0.0036610	Pa×s	254.13	Calculated Property
η	0.0022594	Pa×s	280.26	Calculated Property
η	0.0015141	Pa×s	306.39	Calculated Property
η	0.0010805	Pa×s	332.51	Calculated Property
η	0.0008099	Pa×s	358.64	Calculated Property
η	0.0006314	Pa×s	384.77	Calculated Property
η	0.0005080	Pa×s	410.90	Calculated Property
η	0.0004195	Pa×s	437.03	Calculated Property
η	0.0003540	Pa×s	463.15	Calculated Property
η	0.0003042	Pa×s	489.28	Calculated Property

Similar Compounds

Find more compounds similar to 7-decen-5-olide.

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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