Chemical Properties of Formic acid, decyl ester (CAS 5451-52-5)

InChI

InChI=1S/C11H22O2/c1-2-3-4-5-6-7-8-9-10-13-11-12/h11H,2-10H2,1H3

InChI Key

BCLJZFLDSCTULJ-UHFFFAOYSA-N

Formula

C11H22O2

SMILES

CCCCCCCCCCOC=O

Molecular Weight¹

186.29

CAS

5451-52-5

Other Names

• Decyl formate
• n-Decyl methanoate

• 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).
• 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.
• 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
ΔfG°	-162.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-488.17	kJ/mol	Joback Calculated Property
ΔfusH°	27.72	kJ/mol	Joback Calculated Property
ΔvapH°	49.21	kJ/mol	Joback Calculated Property
log10WS	-3.29		Crippen Calculated Property
logPoct/wat	3.300		Crippen Calculated Property
McVol	173.290	ml/mol	McGowan Calculated Property
Pc	2034.55	kPa	Joback Calculated Property
Inp	[1310.00; 1342.00]
Inp	1342.00		NIST
Inp	1310.00		NIST
Inp	1342.00		NIST
Inp	1310.00		NIST
Tboil	522.16	K	Joback Calculated Property
Tc	689.35	K	Joback Calculated Property
Tfus	277.96	K	Joback Calculated Property
Vc	0.686	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[415.57; 495.24]	J/mol×K	[522.16; 689.35]
Cp,gas	415.57	J/mol×K	522.16	Joback Calculated Property
Cp,gas	430.19	J/mol×K	550.03	Joback Calculated Property
Cp,gas	444.27	J/mol×K	577.89	Joback Calculated Property
Cp,gas	457.80	J/mol×K	605.76	Joback Calculated Property
Cp,gas	470.80	J/mol×K	633.62	Joback Calculated Property
Cp,gas	483.28	J/mol×K	661.49	Joback Calculated Property
Cp,gas	495.24	J/mol×K	689.35	Joback Calculated Property
η	[0.0002242; 0.0036674]	Pa×s	[277.96; 522.16]
η	0.0036674	Pa×s	277.96	Joback Calculated Property
η	0.0017096	Pa×s	318.66	Joback Calculated Property
η	0.0009474	Pa×s	359.36	Joback Calculated Property
η	0.0005920	Pa×s	400.06	Joback Calculated Property
η	0.0004035	Pa×s	440.76	Joback Calculated Property
η	0.0002934	Pa×s	481.46	Joback Calculated Property
η	0.0002242	Pa×s	522.16	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[392.92; 516.61]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.78331e+01
Coefficient B			-5.40892e+03
Coefficient C			-8.46400e+01
Temperature range, min.			392.92
Temperature range, max.			516.61
Pvap	1.33	kPa	392.92	Calculated Property
Pvap	2.82	kPa	406.66	Calculated Property
Pvap	5.61	kPa	420.41	Calculated Property
Pvap	10.56	kPa	434.15	Calculated Property
Pvap	18.97	kPa	447.89	Calculated Property
Pvap	32.64	kPa	461.64	Calculated Property
Pvap	54.07	kPa	475.38	Calculated Property
Pvap	86.54	kPa	489.12	Calculated Property
Pvap	134.30	kPa	502.87	Calculated Property
Pvap	202.66	kPa	516.61	Calculated Property

Similar Compounds

Find more compounds similar to Formic acid, decyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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