Chemical Properties of Adamantan-2-ol (CAS 700-57-2)

InChI

InChI=1S/C10H16O/c11-10-8-2-6-1-7(4-8)5-9(10)3-6/h6-11H,1-5H2

InChI Key

FOWDOWQYRZXQDP-UHFFFAOYSA-N

Formula

C10H16O

SMILES

OC1C2CC3CC(C2)CC1C3

Molecular Weight¹

152.23

CAS

700-57-2

Other Names

• Tricyclo[3.3.1.1

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_subH° : Enthalpy of sublimation 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.
• I : Polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• 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
ΔcH°solid	-5834.00 ± 4.00	kJ/mol	NIST
ΔfG°	51.23	kJ/mol	Joback Calculated Property
ΔfH°gas	-299.00 ± 4.60	kJ/mol	NIST
ΔfH°solid	-388.00 ± 4.00	kJ/mol	NIST
ΔfusH°	20.19	kJ/mol	Joback Calculated Property
ΔsubH°	[88.10; 89.00]	kJ/mol
ΔsubH°	88.10 ± 1.60	kJ/mol	NIST
ΔsubH°	89.00 ± 3.00	kJ/mol	NIST
ΔsubH°	89.00	kJ/mol	NIST
ΔsubH°	88.70 ± 2.50	kJ/mol	NIST
ΔvapH°	53.83	kJ/mol	Joback Calculated Property
IE	[9.09; 9.25]	eV
IE	9.09 ± 0.07	eV	NIST
IE	9.25	eV	NIST
log10WS	-2.10		Crippen Calculated Property
logPoct/wat	1.803		Crippen Calculated Property
McVol	125.050	ml/mol	McGowan Calculated Property
Pc	3314.37	kPa	Joback Calculated Property
Inp	[1329.00; 1405.00]
Inp	1358.00		NIST
Inp	1329.00		NIST
Inp	1348.00		NIST
Inp	1366.00		NIST
Inp	1381.00		NIST
Inp	1383.00		NIST
Inp	1395.00		NIST
Inp	1404.00		NIST
Inp	1329.00		NIST
Inp	1405.00		NIST
Inp	1383.00		NIST
I	[1944.00; 1983.00]
I	1944.00		NIST
I	1962.00		NIST
I	1983.00		NIST
I	1944.00		NIST
Tboil	535.53	K	Joback Calculated Property
Tc	735.26	K	Joback Calculated Property
Tfus	305.10	K	Joback Calculated Property
Vc	0.475	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[341.31; 429.29]	J/mol×K	[535.53; 735.26]
Cp,gas	341.31	J/mol×K	535.53	Joback Calculated Property
Cp,gas	358.46	J/mol×K	568.82	Joback Calculated Property
Cp,gas	374.51	J/mol×K	602.11	Joback Calculated Property
Cp,gas	389.55	J/mol×K	635.39	Joback Calculated Property
Cp,gas	403.64	J/mol×K	668.68	Joback Calculated Property
Cp,gas	416.86	J/mol×K	701.97	Joback Calculated Property
Cp,gas	429.29	J/mol×K	735.26	Joback Calculated Property
η	[0.0010745; 0.0053793]	Pa×s	[305.10; 535.53]
η	0.0053793	Pa×s	305.10	Joback Calculated Property
η	0.0035397	Pa×s	343.50	Joback Calculated Property
η	0.0025337	Pa×s	381.91	Joback Calculated Property
η	0.0019279	Pa×s	420.31	Joback Calculated Property
η	0.0015356	Pa×s	458.72	Joback Calculated Property
η	0.0012669	Pa×s	497.12	Joback Calculated Property
η	0.0010745	Pa×s	535.53	Joback Calculated Property
ΔfusH	[0.30; 11.94]	kJ/mol	[325.20; 567.30]
ΔfusH	0.30	kJ/mol	325.20	NIST
ΔfusH	3.74	kJ/mol	391.20	NIST
ΔfusH	11.94	kJ/mol	567.30	NIST
ΔfusS	[0.92; 9.56]	J/mol×K	[325.20; 391.20]
ΔfusS	0.92	J/mol×K	325.20	NIST
ΔfusS	9.56	J/mol×K	391.20	NIST

Similar Compounds

Find more compounds similar to Adamantan-2-ol.

Sources

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

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