Chemical Properties of Hexamethylene diacrylate (CAS 13048-33-4)

InChI

InChI=1S/C12H18O4/c1-3-11(13)15-9-7-5-6-8-10-16-12(14)4-2/h3-4H,1-2,5-10H2

InChI Key

FIHBHSQYSYVZQE-UHFFFAOYSA-N

Formula

C12H18O4

SMILES

C=CC(=O)OCCCCCCOC(=O)C=C

Molecular Weight¹

226.27

CAS

13048-33-4

Other Names

• Hexamethylene glycol diacrylate
• Sartomer SR 238
• SR 238
• 1,6-Hexamethylene diacrylate
• 1,6-Hexanediol diacrylate
• HDDA
• HDODA
• 2-Propenoic acid, 1,6-hexanediyl ester
• 2-Propenoic acid, 1,1'-(1,6-hexanediyl) ester
• Acrylic acid, hexamethylene ester
• C 716
• Hexamethylene acrylate
• Kayarad HDDA
• NK Ester A-HD
• Photomer 4017
• Sartomer 238
• Setalux UV 2243
• Viscoat 230

• 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).
• 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).
• 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
ω	0.7799		Relay (1.0) Calculated Property
ΔfH°gas	-693.10	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	33.01	kJ/mol	Joback Calculated Property
ΔvapH°	75.57	kJ/mol	Relay (1.0) Calculated Property
IE	9.93	eV	Relay (1.0) Calculated Property
log10WS	-2.95		Relay (1.0) Calculated Property
logPoct/wat	2.005		Crippen Calculated Property
McVol	186.220	ml/mol	McGowan Calculated Property
Pc	1930.44	kPa	Joback Calculated Property
Inp	[1599.00; 1604.00]
Inp	1599.00		NIST
Inp	1604.00		NIST
Inp	1599.00		NIST
Inp	1599.00		NIST
Inp	1604.00		NIST
Tboil	543.50	K	Relay (1.0) Calculated Property
Tc	717.12	K	Relay (1.0) Calculated Property
Tfus	275.59	K	Relay (1.0) Calculated Property
Vc	0.691	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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[273.10; 597.62]	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			3.68160e+01
Coefficient B			9.94200e-01
Coefficient C			-4.85600e-04
Coefficient D			5.22000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	273.10	J/mol×K	273.00	Calculated Property
Cp,gas	330.08	J/mol×K	353.78	Calculated Property
Cp,gas	381.43	J/mol×K	434.56	Calculated Property
Cp,gas	427.34	J/mol×K	515.33	Calculated Property
Cp,gas	467.97	J/mol×K	596.11	Calculated Property
Cp,gas	503.48	J/mol×K	676.89	Calculated Property
Cp,gas	534.03	J/mol×K	757.67	Calculated Property
Cp,gas	559.79	J/mol×K	838.44	Calculated Property
Cp,gas	580.93	J/mol×K	919.22	Calculated Property
Cp,gas	597.62	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0035422; 0.0001934]	Pa×s	[306.14; 533.36]	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			-1.24683e+01
Coefficient B			2.08948e+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.			306.14
Temperature range, max.			533.36
η	0.0035422	Pa×s	306.14	Calculated Property
η	0.0021059	Pa×s	331.39	Calculated Property
η	0.0013477	Pa×s	356.63	Calculated Property
η	0.0009149	Pa×s	381.88	Calculated Property
η	0.0006516	Pa×s	407.13	Calculated Property
η	0.0004829	Pa×s	432.37	Calculated Property
η	0.0003699	Pa×s	457.62	Calculated Property
η	0.0002913	Pa×s	482.87	Calculated Property
η	0.0002350	Pa×s	508.12	Calculated Property
η	0.0001934	Pa×s	533.36	Calculated Property

Similar Compounds

Find more compounds similar to Hexamethylene diacrylate.

Sources

• Cheméo Relay (1.0)
• 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.
These property values are available through the Cheméo API. A free account gives you an access key.