Chemical Properties of 1-Ethyldecalin, isomer 3 (CAS 25551-49-9)

InChI

InChI=1S/C12H22/c1-2-10-7-5-8-11-6-3-4-9-12(10)11/h10-12H,2-9H2,1H3

InChI Key

HUMCBDCARGDFNV-UHFFFAOYSA-N

Formula

C12H22

SMILES

CCC1CCCC2CCCCC12

Molecular Weight¹

166.30

CAS

25551-49-9

Other Names

• 1-Ethyldecalin, isomer 2
• 1-Ethyldecalin, isomer 1
• 1-Ethyldecalin
• 1-Ethyldecalin, isomer 4
• decahydroethylnaphthalene

• 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.
• 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°	115.55	kJ/mol	Joback Calculated Property
ΔfH°gas	-190.39	kJ/mol	Joback Calculated Property
ΔfusH°	15.78	kJ/mol	Joback Calculated Property
ΔvapH°	42.51	kJ/mol	Joback Calculated Property
log10WS	-3.91		Crippen Calculated Property
logPoct/wat	4.003		Crippen Calculated Property
McVol	158.220	ml/mol	McGowan Calculated Property
Pc	2395.87	kPa	Joback Calculated Property
Inp	[1228.00; 1289.00]
Inp	1269.00		NIST
Inp	1228.00		NIST
Inp	1240.00		NIST
Inp	1253.00		NIST
Inp	1239.00		NIST
Inp	1252.00		NIST
Inp	1265.00		NIST
Inp	1258.00		NIST
Inp	1271.00		NIST
Inp	1284.00		NIST
Inp	1262.00		NIST
Inp	1275.00		NIST
Inp	1289.00		NIST
Tboil	499.85	K	Joback Calculated Property
Tc	714.86	K	Joback Calculated Property
Tfus	242.56	K	Joback Calculated Property
Vc	0.589	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[382.91; 507.27]	J/mol×K	[499.85; 714.86]
Cp,gas	382.91	J/mol×K	499.85	Joback Calculated Property
Cp,gas	406.90	J/mol×K	535.69	Joback Calculated Property
Cp,gas	429.53	J/mol×K	571.52	Joback Calculated Property
Cp,gas	450.82	J/mol×K	607.36	Joback Calculated Property
Cp,gas	470.85	J/mol×K	643.19	Joback Calculated Property
Cp,gas	489.65	J/mol×K	679.03	Joback Calculated Property
Cp,gas	507.27	J/mol×K	714.86	Joback Calculated Property
η	[0.0004058; 0.0034936]	Pa×s	[242.56; 499.85]
η	0.0034936	Pa×s	242.56	Joback Calculated Property
η	0.0018638	Pa×s	285.44	Joback Calculated Property
η	0.0011717	Pa×s	328.32	Joback Calculated Property
η	0.0008200	Pa×s	371.20	Joback Calculated Property
η	0.0006179	Pa×s	414.09	Joback Calculated Property
η	0.0004910	Pa×s	456.97	Joback Calculated Property
η	0.0004058	Pa×s	499.85	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Ethyldecalin, isomer 3.

Sources

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

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