Chemical Properties of [3.3.3]Propellane, 2-methylene- (CAS 111917-14-7)

InChI

InChI=1S/C12H18/c1-10-4-9-11-5-2-7-12(10,11)8-3-6-11/h1-9H2

InChI Key

JRBVAAGYBLRKMS-UHFFFAOYSA-N

Formula

C12H18

SMILES

C=C1CCC23CCCC12CCC3

Molecular Weight¹

162.27

CAS

111917-14-7

• ω : Acentric Factor.
• 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).
• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[350.74; 453.44]	J/mol×K	[507.03; 744.52]
Cp,gas	350.74	J/mol×K	507.03	Joback Calculated Property
Cp,gas	371.70	J/mol×K	546.61	Joback Calculated Property
Cp,gas	390.64	J/mol×K	586.19	Joback Calculated Property
Cp,gas	407.92	J/mol×K	625.78	Joback Calculated Property
Cp,gas	423.91	J/mol×K	665.36	Joback Calculated Property
Cp,gas	438.97	J/mol×K	704.94	Joback Calculated Property
Cp,gas	453.44	J/mol×K	744.52	Joback Calculated Property

Similar Compounds

Find more compounds similar to [3.3.3]Propellane, 2-methylene-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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