Chemical Properties of Bicyclo[2.2.1]heptane, 2,2,3-trimethyl- (CAS 473-19-8)

InChI

InChI=1S/C10H18/c1-7-8-4-5-9(6-8)10(7,2)3/h7-9H,4-6H2,1-3H3

InChI Key

XETQTCAMTVHYPO-UHFFFAOYSA-N

Formula

C10H18

SMILES

CC1C2CCC(C2)C1(C)C

Molecular Weight¹

138.25

CAS

473-19-8

Other Names

• Isocamphane
• Dihydrocamphene

• 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).
• 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.
• 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
ΔfG°	121.81	kJ/mol	Joback Calculated Property
ΔfH°gas	-135.73	kJ/mol	Joback Calculated Property
ΔfusH°	11.67	kJ/mol	Joback Calculated Property
ΔvapH°	36.08	kJ/mol	Joback Calculated Property
log10WS	-2.83		Crippen Calculated Property
logPoct/wat	3.079		Crippen Calculated Property
McVol	130.040	ml/mol	McGowan Calculated Property
Pc	2729.71	kPa	Joback Calculated Property
Inp	[1039.00; 1060.00]
Inp	1039.00		NIST
Inp	1052.00		NIST
Inp	1060.00		NIST
Inp	1039.00		NIST
I	1134.00		NIST
Tboil	436.85	K	Joback Calculated Property
Tc	642.10	K	Joback Calculated Property
Tfus	[336.70; 427.00]	K
Tfus	336.70 ± 0.50	K	NIST
Tfus	427.00 ± 2.50	K	NIST
Tfus	360.00 ± 6.00	K	NIST
Vc	0.497	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[287.02; 389.91]	J/mol×K	[436.85; 642.10]
Cp,gas	287.02	J/mol×K	436.85	Joback Calculated Property
Cp,gas	307.28	J/mol×K	471.06	Joback Calculated Property
Cp,gas	326.14	J/mol×K	505.27	Joback Calculated Property
Cp,gas	343.70	J/mol×K	539.47	Joback Calculated Property
Cp,gas	360.10	J/mol×K	573.68	Joback Calculated Property
Cp,gas	375.46	J/mol×K	607.89	Joback Calculated Property
Cp,gas	389.91	J/mol×K	642.10	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[2.2.1]heptane, 2,2,3-trimethyl-.

Sources

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

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