Chemical Properties of 9-Decenoic acid (CAS 14436-32-9)

InChI

InChI=1S/C10H18O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2H,1,3-9H2,(H,11,12)

InChI Key

KHAVLLBUVKBTBG-UHFFFAOYSA-N

Formula

C10H18O2

SMILES

C=CCCCCCCCC(=O)O

Molecular Weight¹

170.25

CAS

14436-32-9

Other Names

• Caproleic acid
• Dec-9-enoic acid

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• P_c : Critical Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• I_np : Non-polar retention indices.
• I_p : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.7899		Relay (1.0) Calculated Property
ΔfG°	-222.75	kJ/mol	Joback Calculated Property
ΔfH°gas	-489.06	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	30.52	kJ/mol	Joback Calculated Property
ΔvapH°	89.87	kJ/mol	Relay (1.0) Calculated Property
IE	9.59	eV	Relay (1.0) Calculated Property
log10WS	-2.94		Relay (1.0) Calculated Property
logPoct/wat	2.988		Crippen Calculated Property
McVol	154.900	ml/mol	McGowan Calculated Property
Pc	2386.52	kPa	Joback Calculated Property
Inp	[1358.00; 1389.20]
Inp	1389.20		NIST
Inp	1358.00		NIST
Inp	1358.00		NIST
Ip	[2305.00; 2369.00]
Ip	2369.00		NIST
Ip	2348.00		NIST
Ip	2357.00		NIST
Ip	2335.00		NIST
Ip	2335.00		NIST
Ip	2305.00		NIST
Ip	2336.00		NIST
Ip	2305.00		NIST
Ip	2341.00		NIST
Ip	2356.00		NIST
Ip	2356.00		NIST
Ip	2305.00		NIST
Ip	2369.00		NIST
Tboil	547.85	K	Relay (1.0) Calculated Property
Tc	732.59	K	Relay (1.0) Calculated Property
Tfus	286.28	K	Relay (1.0) Calculated Property
Vc	0.574	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[221.43; 517.51]	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			-4.59300e+00
Coefficient B			9.84600e-01
Coefficient C			-6.15700e-04
Coefficient D			1.53200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	221.43	J/mol×K	273.00	Calculated Property
Cp,gas	273.46	J/mol×K	353.78	Calculated Property
Cp,gas	319.57	J/mol×K	434.56	Calculated Property
Cp,gas	360.26	J/mol×K	515.33	Calculated Property
Cp,gas	396.00	J/mol×K	596.11	Calculated Property
Cp,gas	427.28	J/mol×K	676.89	Calculated Property
Cp,gas	454.59	J/mol×K	757.67	Calculated Property
Cp,gas	478.41	J/mol×K	838.44	Calculated Property
Cp,gas	499.22	J/mol×K	919.22	Calculated Property
Cp,gas	517.51	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0016559; 0.0002989]	Pa×s	[361.30; 528.43]	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			-1.18167e+01
Coefficient B			1.95582e+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.			361.30
Temperature range, max.			528.43
η	0.0016559	Pa×s	361.30	Calculated Property
η	0.0012709	Pa×s	379.87	Calculated Property
η	0.0009997	Pa×s	398.44	Calculated Property
η	0.0008034	Pa×s	417.01	Calculated Property
η	0.0006578	Pa×s	435.58	Calculated Property
η	0.0005475	Pa×s	454.15	Calculated Property
η	0.0004623	Pa×s	472.72	Calculated Property
η	0.0003953	Pa×s	491.29	Calculated Property
η	0.0003420	Pa×s	509.86	Calculated Property
η	0.0002989	Pa×s	528.43	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[412.52; 602.31]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.38286e+01
Coefficient B			-4.35701e+03
Coefficient C			-9.07560e+01
Temperature range, min.			412.52
Temperature range, max.			602.31
Pvap	1.33	kPa	412.52	Calculated Property
Pvap	3.07	kPa	433.61	Calculated Property
Pvap	6.40	kPa	454.70	Calculated Property
Pvap	12.34	kPa	475.78	Calculated Property
Pvap	22.20	kPa	496.87	Calculated Property
Pvap	37.70	kPa	517.96	Calculated Property
Pvap	60.91	kPa	539.05	Calculated Property
Pvap	94.26	kPa	560.13	Calculated Property
Pvap	140.50	kPa	581.22	Calculated Property
Pvap	202.63	kPa	602.31	Calculated Property

Similar Compounds

Find more compounds similar to 9-Decenoic acid.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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