Chemical Properties of Bicyclo[2.2.1]hept-2-ene, 2,3-dimethyl- (CAS 529-16-8)

InChI

InChI=1S/C9H14/c1-6-7(2)9-4-3-8(6)5-9/h8-9H,3-5H2,1-2H3

InChI Key

LSIXBBPOJBJQHN-UHFFFAOYSA-N

Formula

C9H14

SMILES

CC1=C(C)C2CCC1C2

Molecular Weight¹

122.21

CAS

529-16-8

Other Names

• 2-Norbornene, 2,3-dimethyl-
• Santen
• Santene

• 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).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	13.68	kJ/mol	Joback Calculated Property
IE	8.19	eV	Relay (1.0) Calculated Property
logPoct/wat	2.753		Crippen Calculated Property
McVol	111.650	ml/mol	McGowan Calculated Property
Inp	[863.00; 891.00]
Inp	880.00		NIST
Inp	887.00		NIST
Inp	887.00		NIST
Inp	890.00		NIST
Inp	885.30		NIST
Inp	876.00		NIST
Inp	Outlier 863.00		NIST
Inp	884.00		NIST
Inp	877.00		NIST
Inp	880.00		NIST
Inp	889.00		NIST
Inp	883.00		NIST
Inp	883.00		NIST
Inp	883.00		NIST
Inp	891.00		NIST
Inp	880.00		NIST
Inp	885.30		NIST
I	[984.00; 1018.00]
I	984.00		NIST
I	997.00		NIST
I	991.00		NIST
I	1000.00		NIST
I	1018.00		NIST
I	984.00		NIST

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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[231.81; 314.36]	J/mol×K	[432.19; 636.56]
Cp,gas	231.81	J/mol×K	432.19	Joback Calculated Property
Cp,gas	247.76	J/mol×K	466.25	Joback Calculated Property
Cp,gas	262.76	J/mol×K	500.31	Joback Calculated Property
Cp,gas	276.87	J/mol×K	534.38	Joback Calculated Property
Cp,gas	290.14	J/mol×K	568.44	Joback Calculated Property
Cp,gas	302.62	J/mol×K	602.50	Joback Calculated Property
Cp,gas	314.36	J/mol×K	636.56	Joback Calculated Property
η	[0.0005129; 0.0006519]	Pa×s	[249.35; 432.19]
η	0.0006519	Pa×s	249.35	Joback Calculated Property
η	0.0006129	Pa×s	279.82	Joback Calculated Property
η	0.0005832	Pa×s	310.30	Joback Calculated Property
η	0.0005600	Pa×s	340.77	Joback Calculated Property
η	0.0005412	Pa×s	371.24	Joback Calculated Property
η	0.0005258	Pa×s	401.72	Joback Calculated Property
η	0.0005129	Pa×s	432.19	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[2.2.1]hept-2-ene, 2,3-dimethyl-.

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
These property values are available through the Cheméo API. A free account gives you an access key.