Chemical Properties of Succinic acid, 3,7-dimethyloct-6-en-1-yl hexadecyl ester

InChI

InChI=1S/C30H56O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-33-29(31)22-23-30(32)34-26-24-28(4)21-19-20-27(2)3/h20,28H,5-19,21-26H2,1-4H3

InChI Key

IIFRFNXLJOVISE-UHFFFAOYSA-N

Formula

C30H56O4

SMILES

CCCCCCCCCCCCCCCCOC(=O)CCC(=O)OCCC(C)CCC=C(C)C

Molecular Weight¹

480.76

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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°	-196.89	kJ/mol	Joback Calculated Property
ΔfH°gas	-1049.98	kJ/mol	Joback Calculated Property
ΔfusH°	74.40	kJ/mol	Joback Calculated Property
ΔvapH°	100.34	kJ/mol	Joback Calculated Property
log10WS	-9.72		Crippen Calculated Property
logPoct/wat	9.107		Crippen Calculated Property
McVol	444.140	ml/mol	McGowan Calculated Property
Pc	643.85	kPa	Joback Calculated Property
Inp	[3265.00; 3265.00]
Inp	3265.00		NIST
Inp	3265.00		NIST
Tboil	1041.98	K	Joback Calculated Property
Tc	1299.12	K	Joback Calculated Property
Tfus	538.14	K	Joback Calculated Property
Vc	1.738	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1576.77; 1687.78]	J/mol×K	[1041.98; 1299.12]
Cp,gas	1576.77	J/mol×K	1041.98	Joback Calculated Property
Cp,gas	1600.08	J/mol×K	1084.84	Joback Calculated Property
Cp,gas	1621.31	J/mol×K	1127.69	Joback Calculated Property
Cp,gas	1640.56	J/mol×K	1170.55	Joback Calculated Property
Cp,gas	1657.97	J/mol×K	1213.40	Joback Calculated Property
Cp,gas	1673.67	J/mol×K	1256.26	Joback Calculated Property
Cp,gas	1687.78	J/mol×K	1299.12	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3,7-dimethyloct-6-en-1-yl hexadecyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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