Chemical Properties of Oppositadiene

InChI

InChI=1S/C15H24/c1-11(2)10-13-7-9-15(4)8-5-6-12(3)14(13)15/h10,13-14H,3,5-9H2,1-2,4H3/t13-,14-,15-/m0/s1

InChI Key

VDZLIVJTPHFVKL-KKUMJFAQSA-N

Formula

C15H24

SMILES

C=C1CCCC2(C)CCC(C=C(C)C)C12

Molecular Weight¹

204.35

• 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°	272.17	kJ/mol	Joback Calculated Property
ΔfH°gas	-39.24	kJ/mol	Joback Calculated Property
ΔfusH°	17.08	kJ/mol	Joback Calculated Property
ΔvapH°	48.06	kJ/mol	Joback Calculated Property
log10WS	-4.87		Crippen Calculated Property
logPoct/wat	4.725		Crippen Calculated Property
McVol	191.890	ml/mol	McGowan Calculated Property
Pc	2001.91	kPa	Joback Calculated Property
Inp	[1393.00; 1423.00]
Inp	1393.00		NIST
Inp	1423.00		NIST
Inp	1423.00		NIST
Tboil	567.66	K	Joback Calculated Property
Tc	788.60	K	Joback Calculated Property
Tfus	298.43	K	Joback Calculated Property
Vc	0.728	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[498.58; 616.99]	J/mol×K	[567.66; 788.60]
Cp,gas	498.58	J/mol×K	567.66	Joback Calculated Property
Cp,gas	521.39	J/mol×K	604.48	Joback Calculated Property
Cp,gas	542.75	J/mol×K	641.31	Joback Calculated Property
Cp,gas	562.82	J/mol×K	678.13	Joback Calculated Property
Cp,gas	581.77	J/mol×K	714.95	Joback Calculated Property
Cp,gas	599.77	J/mol×K	751.77	Joback Calculated Property
Cp,gas	616.99	J/mol×K	788.60	Joback Calculated Property

Similar Compounds

Find more compounds similar to Oppositadiene.

Sources

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

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