Chemical Properties of Tricyclo[2.2.1.0(2,6)]heptan-3-ol, 4,5,5-trimethyl- (CAS 62560-53-6)

InChI

InChI=1S/C10H16O/c1-9(2)7-5-4-10(9,3)8(11)6(5)7/h5-8,11H,4H2,1-3H3

InChI Key

DVHLXMZZPWNOGD-UHFFFAOYSA-N

Formula

C10H16O

SMILES

CC1(C)C2C3CC1(C)C(O)C32

Molecular Weight¹

152.23

CAS

62560-53-6

Other Names

• «beta»-Pericyclocamphanol

• 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).
• I_np : Non-polar retention indices.
• 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
ω	0.4404		Relay (1.0) Calculated Property
ΔfG°	68.84	kJ/mol	Joback Calculated Property
ΔfH°gas	-145.25	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	14.97	kJ/mol	Joback Calculated Property
ΔvapH°	70.28	kJ/mol	Relay (1.0) Calculated Property
IE	8.84	eV	Relay (1.0) Calculated Property
log10WS	-2.92		Relay (1.0) Calculated Property
logPoct/wat	1.659		Crippen Calculated Property
McVol	125.050	ml/mol	McGowan Calculated Property
Pc	3246.73	kPa	Joback Calculated Property
Inp	[1149.00; 1149.00]
Inp	1149.00		NIST
Inp	1149.00		NIST
Tboil	460.73	K	Relay (1.0) Calculated Property
Tc	744.56	K	Relay (1.0) Calculated Property
Tfus	471.43	K	Relay (1.0) Calculated Property
Vc	0.455	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[340.10; 414.46]	J/mol×K	[518.53; 712.79]
Cp,gas	340.10	J/mol×K	518.53	Joback Calculated Property
Cp,gas	354.82	J/mol×K	550.91	Joback Calculated Property
Cp,gas	368.35	J/mol×K	583.28	Joback Calculated Property
Cp,gas	380.87	J/mol×K	615.66	Joback Calculated Property
Cp,gas	392.59	J/mol×K	648.04	Joback Calculated Property
Cp,gas	403.72	J/mol×K	680.41	Joback Calculated Property
Cp,gas	414.46	J/mol×K	712.79	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tricyclo[2.2.1.0(2,6)]heptan-3-ol, 4,5,5-trimethyl-.

Sources

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

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