Chemical Properties of 2-Norbornanethione, 1,3,3-trimethyl- (CAS 875-06-9)

InChI

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

InChI Key

LZCJFUYIXHJWPV-UHFFFAOYSA-N

Formula

C10H16S

SMILES

CC12CCC(C1)C(C)(C)C2=S

Molecular Weight¹

168.30

CAS

875-06-9

Other Names

• Bicyclo[2.2.1]heptane-2-thione, 1,3,3-trimethyl-
• Thiofenchone

• 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

Property	Value	Unit	Source
ΔfG°	214.88	kJ/mol	Joback Calculated Property
ΔfH°gas	14.95	kJ/mol	Joback Calculated Property
ΔfusH°	10.33	kJ/mol	Joback Calculated Property
ΔvapH°	42.72	kJ/mol	Joback Calculated Property
IE	[8.13; 8.41]	eV
IE	8.13	eV	NIST
IE	8.41	eV	NIST
log10WS	-3.43		Crippen Calculated Property
logPoct/wat	3.203		Crippen Calculated Property
McVol	142.090	ml/mol	McGowan Calculated Property
Pc	3184.73	kPa	Joback Calculated Property
Tboil	514.40	K	Joback Calculated Property
Tc	751.23	K	Joback Calculated Property
Tfus	342.05	K	Joback Calculated Property
Vc	0.534	m3/kmol	Joback Calculated Property

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 2-Norbornanethione, 1,3,3-trimethyl-.

Sources

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

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