Chemical Properties of Decyl acrylate (CAS 2156-96-9)

InChI

InChI=1S/C13H24O2/c1-3-5-6-7-8-9-10-11-12-15-13(14)4-2/h4H,2-3,5-12H2,1H3

InChI Key

FWLDHHJLVGRRHD-UHFFFAOYSA-N

Formula

C13H24O2

SMILES

C=CC(=O)OCCCCCCCCCC

Molecular Weight¹

212.33

CAS

2156-96-9

• ω : Acentric Factor.
• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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 : 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	0.7312		Relay (1.0) Calculated Property
ΔfH°gas	-516.25	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	32.52	kJ/mol	Joback Calculated Property
ΔvapH°	71.56	kJ/mol	Relay (1.0) Calculated Property
IE	9.88	eV	Relay (1.0) Calculated Property
log10WS	-4.63		Relay (1.0) Calculated Property
logPoct/wat	3.856		Crippen Calculated Property
McVol	197.170	ml/mol	McGowan Calculated Property
Pc	1708.95	kPa	Joback Calculated Property
Inp	[1474.00; 1493.00]
Inp	1474.00		NIST
Inp	1474.00		NIST
Inp	1493.00		NIST
Inp	1493.00		NIST
Inp	1493.00		NIST
Inp	1474.00		NIST
I	[1789.00; 1795.00]
I	1789.00		NIST
I	1795.00		NIST
I	1789.00		NIST
Tboil	523.92	K	Relay (1.0) Calculated Property
Tc	712.55	K	Relay (1.0) Calculated Property
Tfus	258.56	K	Relay (1.0) Calculated Property
Vc	0.756	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[287.79; 669.61]	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			1.34890e+01
Coefficient B			1.16402e+00
Coefficient C			-6.11700e-04
Coefficient D			1.03800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	287.79	J/mol×K	273.00	Calculated Property
Cp,gas	353.33	J/mol×K	353.78	Calculated Property
Cp,gas	412.33	J/mol×K	434.56	Calculated Property
Cp,gas	465.10	J/mol×K	515.33	Calculated Property
Cp,gas	512.00	J/mol×K	596.11	Calculated Property
Cp,gas	553.33	J/mol×K	676.89	Calculated Property
Cp,gas	589.42	J/mol×K	757.67	Calculated Property
Cp,gas	620.62	J/mol×K	838.44	Calculated Property
Cp,gas	647.24	J/mol×K	919.22	Calculated Property
Cp,gas	669.61	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0045826; 0.0002212]	Pa×s	[276.84; 504.56]	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			-1.21008e+01
Coefficient B			1.85908e+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.			276.84
Temperature range, max.			504.56
η	0.0045826	Pa×s	276.84	Calculated Property
η	0.0026114	Pa×s	302.14	Calculated Property
η	0.0016233	Pa×s	327.44	Calculated Property
η	0.0010803	Pa×s	352.75	Calculated Property
η	0.0007592	Pa×s	378.05	Calculated Property
η	0.0005577	Pa×s	403.35	Calculated Property
η	0.0004248	Pa×s	428.65	Calculated Property
η	0.0003336	Pa×s	453.96	Calculated Property
η	0.0002687	Pa×s	479.26	Calculated Property
η	0.0002212	Pa×s	504.56	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[410.12; 565.09]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.56693e+01
Coefficient B			-4.91451e+03
Coefficient C			-9.06170e+01
Temperature range, min.			410.12
Temperature range, max.			565.09
Pvap	1.33	kPa	410.12	Calculated Property
Pvap	2.93	kPa	427.34	Calculated Property
Pvap	5.95	kPa	444.56	Calculated Property
Pvap	11.34	kPa	461.78	Calculated Property
Pvap	20.40	kPa	479.00	Calculated Property
Pvap	34.90	kPa	496.21	Calculated Property
Pvap	57.17	kPa	513.43	Calculated Property
Pvap	90.10	kPa	530.65	Calculated Property
Pvap	137.20	kPa	547.87	Calculated Property
Pvap	202.65	kPa	565.09	Calculated Property

Similar Compounds

Find more compounds similar to Decyl acrylate.

Sources

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

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.
These property values are available through the Cheméo API. A free account gives you an access key.