Chemical Properties of Bicyclo[2.2.1]heptane-2-thione, 1,7,7-trimethyl- (CAS 7519-74-6)

InChI

InChI=1S/C10H16S/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3

InChI Key

AAADKYXUTOBAGS-UHFFFAOYSA-N

Formula

C10H16S

SMILES

CC12CCC(CC1=S)C2(C)C

Molecular Weight¹

168.30

CAS

7519-74-6

Other Names

• 2-Bornanethione
• Thiocamphor

• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, 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	[333.24; 417.65]	J/mol×K	[514.40; 751.23]
Cp,gas	333.24	J/mol×K	514.40	Joback Calculated Property
Cp,gas	350.23	J/mol×K	553.87	Joback Calculated Property
Cp,gas	365.61	J/mol×K	593.34	Joback Calculated Property
Cp,gas	379.71	J/mol×K	632.81	Joback Calculated Property
Cp,gas	392.86	J/mol×K	672.28	Joback Calculated Property
Cp,gas	405.40	J/mol×K	711.76	Joback Calculated Property
Cp,gas	417.65	J/mol×K	751.23	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[2.2.1]heptane-2-thione, 1,7,7-trimethyl-.

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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