Chemical Properties of 2-Chloroadamantane (CAS 7346-41-0)

InChI

InChI=1S/C10H15Cl/c11-10-8-2-6-1-7(4-8)5-9(10)3-6/h6-10H,1-5H2

InChI Key

DPCLLPAHJSYBTE-UHFFFAOYSA-N

Formula

C10H15Cl

SMILES

ClC1C2CC3CC(C2)CC1C3

Molecular Weight¹

170.68

CAS

7346-41-0

Other Names

• Tricyclo[3.3.1.1(3,7)-]decane, 2-chloro-
• Adamantane, 2-chloro
• 2-chlorotricyclo[3.3.1.13,7]decane

• 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_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_subH° : Enthalpy of sublimation 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°	176.12	kJ/mol	Joback Calculated Property
ΔfH°gas	-93.91	kJ/mol	Joback Calculated Property
ΔfusH°	20.30	kJ/mol	Joback Calculated Property
ΔsubH°	61.50 ± 0.80	kJ/mol	NIST
ΔvapH°	41.53	kJ/mol	Joback Calculated Property
log10WS	-2.99		Crippen Calculated Property
logPoct/wat	3.050		Crippen Calculated Property
McVol	131.420	ml/mol	McGowan Calculated Property
Pc	2871.95	kPa	Joback Calculated Property
Inp	[1342.00; 1404.00]
Inp	1350.00		NIST
Inp	1345.00		NIST
Inp	1342.00		NIST
Inp	1361.00		NIST
Inp	1376.00		NIST
Inp	Outlier 1404.00		NIST
Inp	1342.00		NIST
Inp	1342.00		NIST
Inp	1350.00		NIST
I	[1738.00; 1791.00]
I	1745.00		NIST
I	1741.00		NIST
I	1738.00		NIST
I	1765.00		NIST
I	1791.00		NIST
Tboil	480.78	K	Joback Calculated Property
Tc	700.35	K	Joback Calculated Property
Tfus	274.20	K	Joback Calculated Property
Vc	0.505	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[307.29; 409.42]	J/mol×K	[480.78; 700.35]
Cp,gas	307.29	J/mol×K	480.78	Joback Calculated Property
Cp,gas	327.56	J/mol×K	517.38	Joback Calculated Property
Cp,gas	346.41	J/mol×K	553.97	Joback Calculated Property
Cp,gas	363.92	J/mol×K	590.57	Joback Calculated Property
Cp,gas	380.20	J/mol×K	627.16	Joback Calculated Property
Cp,gas	395.33	J/mol×K	663.76	Joback Calculated Property
Cp,gas	409.42	J/mol×K	700.35	Joback Calculated Property
η	[0.0008313; 0.0015711]	Pa×s	[274.20; 480.78]
η	0.0008313	Pa×s	274.20	Joback Calculated Property
η	0.0009807	Pa×s	308.63	Joback Calculated Property
η	0.0011192	Pa×s	343.06	Joback Calculated Property
η	0.0012468	Pa×s	377.49	Joback Calculated Property
η	0.0013641	Pa×s	411.92	Joback Calculated Property
η	0.0014719	Pa×s	446.35	Joback Calculated Property
η	0.0015711	Pa×s	480.78	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Chloroadamantane.

Sources

• 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.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.