Chemical Properties of carane-3,4-diol

InChI

InChI=1S/C10H18O2/c1-9(2)6-4-8(11)10(3,12)5-7(6)9/h6-8,11-12H,4-5H2,1-3H3

InChI Key

AHVKNBRJVKCGKJ-UHFFFAOYSA-N

Formula

C10H18O2

SMILES

CC1(O)CC2C(CC1O)C2(C)C

Molecular Weight¹

170.25

• 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 : 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	0.5843		Relay (... Calculated Property
ΔfG°	-165.03	kJ/mol	Joback Calculated Property
ΔfH°gas	-396.63	kJ/mol	Relay (... Calculated Property
ΔfusH°	14.62	kJ/mol	Joback Calculated Property
ΔvapH°	94.93	kJ/mol	Relay (... Calculated Property
IE	9.09	eV	Relay (... Calculated Property
log10WS	-1.95		Relay (... Calculated Property
logPoct/wat	1.164		Crippen Calculated Property
McVol	141.780	ml/mol	McGowan Calculated Property
Pc	3388.08	kPa	Joback Calculated Property
I	[2170.00; 2170.00]
I	2170.00		NIST
I	2170.00		NIST
I	2170.00		NIST
Tboil	511.60	K	Relay (... Calculated Property
Tc	752.36	K	Relay (... Calculated Property
Tfus	385.39	K	Relay (... Calculated Property
Vc	0.518	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[414.70; 487.59]	J/mol×K	[616.78; 805.96]
Cp,gas	414.70	J/mol×K	616.78	Joback Calculated Property
Cp,gas	427.85	J/mol×K	648.31	Joback Calculated Property
Cp,gas	440.40	J/mol×K	679.84	Joback Calculated Property
Cp,gas	452.49	J/mol×K	711.37	Joback Calculated Property
Cp,gas	464.29	J/mol×K	742.90	Joback Calculated Property
Cp,gas	475.94	J/mol×K	774.43	Joback Calculated Property
Cp,gas	487.59	J/mol×K	805.96	Joback Calculated Property

Similar Compounds

Find more compounds similar to carane-3,4-diol.

Sources

• Cheméo Relay (1.0)
• 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.