Chemical Properties of Ethanone, 1-cyclododecyl- (CAS 28925-00-0)

InChI

InChI=1S/C14H26O/c1-13(15)14-11-9-7-5-3-2-4-6-8-10-12-14/h14H,2-12H2,1H3

InChI Key

FTPUBZGARRXJIM-UHFFFAOYSA-N

Formula

C14H26O

SMILES

CC(=O)C1CCCCCCCCCCC1

Molecular Weight¹

210.36

CAS

28925-00-0

Other Names

• Ketone, cyclododecyl methyl
• 1-Cyclododecylethanone
• Acetylcyclododecane
• 1-Cyclododecylethan-1-one
• Cyclododecyl methyl ketone

• 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_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°	-110.07	kJ/mol	Joback Calculated Property
ΔfH°gas	-427.51	kJ/mol	Joback Calculated Property
ΔfusH°	12.85	kJ/mol	Joback Calculated Property
ΔvapH°	54.97	kJ/mol	Joback Calculated Property
log10WS	-4.62		Crippen Calculated Property
logPoct/wat	4.496		Crippen Calculated Property
McVol	198.830	ml/mol	McGowan Calculated Property
Pc	2175.46	kPa	Joback Calculated Property
Inp	[1645.60; 1683.30]
Inp	1645.60		NIST
Inp	1683.30		NIST
I	[2067.30; 2134.90]
I	2067.30		NIST
I	2134.90		NIST
Tboil	618.76	K	Joback Calculated Property
Tc	857.22	K	Joback Calculated Property
Tfus	283.73	K	Joback Calculated Property
Vc	0.711	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[543.80; 677.73]	J/mol×K	[618.76; 857.22]
Cp,gas	543.80	J/mol×K	618.76	Joback Calculated Property
Cp,gas	570.63	J/mol×K	658.50	Joback Calculated Property
Cp,gas	595.68	J/mol×K	698.25	Joback Calculated Property
Cp,gas	618.92	J/mol×K	737.99	Joback Calculated Property
Cp,gas	640.35	J/mol×K	777.74	Joback Calculated Property
Cp,gas	659.96	J/mol×K	817.48	Joback Calculated Property
Cp,gas	677.73	J/mol×K	857.22	Joback Calculated Property
η	[0.0000391; 0.0204220]	Pa×s	[283.73; 618.76]
η	0.0204220	Pa×s	283.73	Joback Calculated Property
η	0.0030527	Pa×s	339.57	Joback Calculated Property
η	0.0007805	Pa×s	395.41	Joback Calculated Property
η	0.0002797	Pa×s	451.25	Joback Calculated Property
η	0.0001256	Pa×s	507.08	Joback Calculated Property
η	0.0000662	Pa×s	562.92	Joback Calculated Property
η	0.0000391	Pa×s	618.76	Joback Calculated Property

Similar Compounds

Find more compounds similar to Ethanone, 1-cyclododecyl-.

Sources

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

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