Chemical Properties of 2-Dodecen-1-yl(-)succinic anhydride (CAS 19780-11-1)

InChI

InChI=1S/C16H26O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-13-15(17)19-16(14)18/h10-11,14H,2-9,12-13H2,1H3/b11-10+

InChI Key

UYCICMIUKYEYEU-ZHACJKMWSA-N

Formula

C16H26O3

SMILES

CCCCCCCCCC=CCC1CC(=O)OC1=O

Molecular Weight¹

266.38

CAS

19780-11-1

Other Names

• 2,5-Furandione, 3-dodecenyl-
• n-Dodecenylsuccinic anhydride
• Dodecenyl succinic anhydride
• 2,5-Furandione, 3-(2-dodecenyl)dihydro-
• 2-Dodecen-1-ylsuccinic anhydride
• 3-(2-dodecenyl)succinic anhydride

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	39.41	kJ/mol	Joback Calculated Property
ΔvapH°	92.79	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	4.163		Crippen Calculated Property
McVol	230.150	ml/mol	McGowan Calculated Property
Inp	[1966.00; 1966.00]
Inp	1966.00		NIST
Inp	1966.00		NIST
Tboil	625.93	K	Relay (1.0) Calculated Property
Tfus	299.59	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[330.16; 801.18]	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			-1.42410e+01
Coefficient B			1.47162e+00
Coefficient C			-8.12000e-04
Coefficient D			1.55800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	330.16	J/mol×K	273.00	Calculated Property
Cp,gas	411.66	J/mol×K	353.78	Calculated Property
Cp,gas	484.71	J/mol×K	434.56	Calculated Property
Cp,gas	549.81	J/mol×K	515.33	Calculated Property
Cp,gas	607.47	J/mol×K	596.11	Calculated Property
Cp,gas	658.16	J/mol×K	676.89	Calculated Property
Cp,gas	702.39	J/mol×K	757.67	Calculated Property
Cp,gas	740.63	J/mol×K	838.44	Calculated Property
Cp,gas	773.40	J/mol×K	919.22	Calculated Property
Cp,gas	801.18	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 2-Dodecen-1-yl(-)succinic anhydride.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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