Chemical Properties of ( S)-camphor

InChI

InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3/t7-,10+/m0/s1

InChI Key

DSSYKIVIOFKYAU-OIBJUYFYSA-N

Formula

C10H16O

SMILES

CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2

Molecular Weight¹

152.24

Other Names

• (-)-2-bornanone
• (-)-alcanfor
• (-)-camphor
• (1S)-(-)-camphor
• (1S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
• bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-, (1S)-
• camphor, (1S,4S)-(-)-
• l-camphor

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-170.82	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	3.81	kJ/mol	Joback Calculated Property
ΔvapH°	51.53	kJ/mol	Relay (1.0) Calculated Property
IE	9.18	eV	Relay (1.0) Calculated Property
logPoct/wat	2.402		Crippen Calculated Property
McVol	131.610	ml/mol	McGowan Calculated Property
Inp	[1142.00; 1142.00]
Inp	1142.00		NIST
Inp	1142.00		NIST
I	[1509.00; 1509.00]
I	1509.00		NIST
I	1509.00		NIST
Tboil	472.43	K	Relay (1.0) Calculated Property
Tfus	448.50	K	Thermodynamic study of selected monoterpenes II
Ttriple	453.90	K	Dielectric and thermodynamic study of camphor and borneol enantiomers and their binary systems

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[166.62; 516.94]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.69420e+02
Coefficient B			1.63506e+00
Coefficient C			-1.68000e-03
Coefficient D			7.31300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	166.62	J/mol×K	273.00	Calculated Property
Cp,gas	231.14	J/mol×K	353.78	Calculated Property
Cp,gas	283.87	J/mol×K	434.56	Calculated Property
Cp,gas	327.11	J/mol×K	515.33	Calculated Property
Cp,gas	363.18	J/mol×K	596.11	Calculated Property
Cp,gas	394.40	J/mol×K	676.89	Calculated Property
Cp,gas	423.07	J/mol×K	757.67	Calculated Property
Cp,gas	451.51	J/mol×K	838.44	Calculated Property
Cp,gas	482.03	J/mol×K	919.22	Calculated Property
Cp,gas	516.94	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to ( S)-camphor.

Mixtures

• Ethanol + ( S)-camphor
• Ethanol + (+)-2-Bornanone + ( S)-camphor

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
• Thermodynamic properties of ethanol solution of chiral camphors and its derivatives
• Thermodynamic study of selected monoterpenes II
• Dielectric and thermodynamic study of camphor and borneol enantiomers and their binary systems
• 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.
These property values are available through the Cheméo API. A free account gives you an access key.