Chemical Properties of Bicyclo[2.2.1]heptan-2-ol, 2,3,3-trimethyl- (CAS 465-31-6)

InChI

InChI=1S/C10H18O/c1-9(2)7-4-5-8(6-7)10(9,3)11/h7-8,11H,4-6H2,1-3H3

InChI Key

PXRCIOIWVGAZEP-UHFFFAOYSA-N

Formula

C10H18O

SMILES

CC1(C)C2CCC(C2)C1(C)O

Molecular Weight¹

154.25

CAS

465-31-6

Other Names

• 2-Norbornanol
• 3-Methylcamphenilanol
• 3-Methylcamphenilol
• Camphene hydrate
• Camphenilanol, 3-methyl-

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	9.46	kJ/mol	Joback Calculated Property
ΔvapH°	62.79	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	2.194		Crippen Calculated Property
McVol	135.910	ml/mol	McGowan Calculated Property
Inp	[1112.00; 1195.00]
Inp	1148.00		NIST
Inp	1128.00		NIST
Inp	1148.00		NIST
Inp	1150.00		NIST
Inp	1142.00		NIST
Inp	1148.00		NIST
Inp	1148.00		NIST
Inp	1148.00		NIST
Inp	1148.00		NIST
Inp	1148.00		NIST
Inp	1148.00		NIST
Inp	1148.00		NIST
Inp	1140.00		NIST
Inp	1148.00		NIST
Inp	1154.00		NIST
Inp	1146.00		NIST
Inp	1151.00		NIST
Inp	1150.00		NIST
Inp	1150.00		NIST
Inp	1147.00		NIST
Inp	1155.00		NIST
Inp	1149.00		NIST
Inp	1157.00		NIST
Inp	1150.00		NIST
Inp	Outlier 1195.00		NIST
Inp	1128.00		NIST
Inp	1150.00		NIST
Inp	1150.00		NIST
Inp	1147.00		NIST
Inp	1147.00		NIST
Inp	1155.00		NIST
Inp	1152.00		NIST
Inp	1147.00		NIST
Inp	1148.00		NIST
Inp	1148.00		NIST
Inp	1148.00		NIST
Inp	1129.00		NIST
Inp	1151.00		NIST
Inp	1154.00		NIST
Inp	1147.00		NIST
Inp	1133.00		NIST
Inp	1127.00		NIST
Inp	1141.00		NIST
Inp	1135.00		NIST
Inp	Outlier 1112.00		NIST
Inp	1132.00		NIST
Inp	1128.00		NIST
Inp	1150.00		NIST
Inp	Outlier 1185.00		NIST
Inp	1128.00		NIST
Inp	1147.00		NIST
Inp	1130.00		NIST
Inp	1127.00		NIST
Inp	1152.00		NIST
Inp	1150.00		NIST
Inp	1156.00		NIST
Inp	1155.00		NIST
Inp	1156.00		NIST
Inp	1150.00		NIST
Inp	1146.00		NIST
Inp	1146.00		NIST
Inp	1150.00		NIST
Inp	1150.00		NIST
Inp	1140.00		NIST
Inp	1148.00		NIST
Inp	1140.00		NIST
Inp	1136.00		NIST
Inp	1148.00		NIST
Inp	Outlier 1195.00		NIST
Inp	1150.00		NIST
Inp	1146.00		NIST
Inp	1128.00		NIST
Inp	1155.00		NIST
Inp	1133.00		NIST
Inp	1132.00		NIST
Inp	1147.00		NIST
Inp	1154.00		NIST
I	[1518.00; 1602.00]
I	1518.00		NIST
I	1591.00		NIST
I	1602.00		NIST
I	1545.00		NIST
I	1596.00		NIST
I	1589.00		NIST
I	1518.00		NIST
I	1591.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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	[354.30; 436.70]	J/mol×K	[529.27; 730.21]
Cp,gas	354.30	J/mol×K	529.27	Joback Calculated Property
Cp,gas	370.25	J/mol×K	562.76	Joback Calculated Property
Cp,gas	385.05	J/mol×K	596.25	Joback Calculated Property
Cp,gas	398.92	J/mol×K	629.74	Joback Calculated Property
Cp,gas	412.02	J/mol×K	663.23	Joback Calculated Property
Cp,gas	424.55	J/mol×K	696.72	Joback Calculated Property
Cp,gas	436.70	J/mol×K	730.21	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[2.2.1]heptan-2-ol, 2,3,3-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

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.
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