Chemical Properties of Bicyclo[2.2.1]hept-5-ene, 2-acetyl-

InChI

InChI=1S/C9H12O/c1-6(10)9-5-7-2-3-8(9)4-7/h2-3,7-9H,4-5H2,1H3

InChI Key

NIMLCWCLVJRPFY-UHFFFAOYSA-N

Formula

C9H12O

SMILES

CC(=O)C1CC2C=CC1C2

Molecular Weight¹

136.19

Other Names

• 5-Acetyl-2-norbornene
• Ethanone, 1-bicyclo[2.2.1]hept-5-en-2-yl-
• Bicyclo[2.2.1]hept-2-ene, 5-acetyl-
• methyl (8,9,10-trinorborn-5-en-2-yl) ketone

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boilr : Boiling point at reduced pressure (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[141.34; 409.28]	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			-8.98200e+01
Coefficient B			1.04052e+00
Coefficient C			-7.72980e-04
Coefficient D			2.31560e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	141.34	J/mol×K	273.00	Calculated Property
Cp,gas	191.80	J/mol×K	353.78	Calculated Property
Cp,gas	235.38	J/mol×K	434.56	Calculated Property
Cp,gas	272.81	J/mol×K	515.33	Calculated Property
Cp,gas	304.82	J/mol×K	596.11	Calculated Property
Cp,gas	332.15	J/mol×K	676.89	Calculated Property
Cp,gas	355.53	J/mol×K	757.67	Calculated Property
Cp,gas	375.69	J/mol×K	838.44	Calculated Property
Cp,gas	393.36	J/mol×K	919.22	Calculated Property
Cp,gas	409.28	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0012230; 0.0008266]	Pa×s	[270.00; 479.11]	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			-7.60392e+00
Coefficient B			2.42310e+02
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.			270.00
Temperature range, max.			479.11
η	0.0012230	Pa×s	270.00	Calculated Property
η	0.0011390	Pa×s	293.23	Calculated Property
η	0.0010720	Pa×s	316.47	Calculated Property
η	0.0010173	Pa×s	339.70	Calculated Property
η	0.0009719	Pa×s	362.94	Calculated Property
η	0.0009336	Pa×s	386.17	Calculated Property
η	0.0009009	Pa×s	409.41	Calculated Property
η	0.0008728	Pa×s	432.64	Calculated Property
η	0.0008482	Pa×s	455.88	Calculated Property
η	0.0008266	Pa×s	479.11	Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[2.2.1]hept-5-ene, 2-acetyl-.

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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