Chemical Properties of 1-Decene, 3,4-dimethyl- (CAS 50871-03-9)

InChI

InChI=1S/C12H24/c1-5-7-8-9-10-12(4)11(3)6-2/h6,11-12H,2,5,7-10H2,1,3-4H3

InChI Key

UQFBFCHTLWGJAE-UHFFFAOYSA-N

Formula

C12H24

SMILES

C=CC(C)C(C)CCCCCC

Molecular Weight¹

168.32

CAS

50871-03-9

Other Names

• 3,4-Dimethyl-1-decene

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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).
• P_vap : Vapor pressure (kPa).
• 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
ω	0.4410		Relay (1.0) Calculated Property
ΔfG°	133.12	kJ/mol	Joback Calculated Property
ΔfH°gas	-180.57	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	18.51	kJ/mol	Joback Calculated Property
ΔvapH°	54.28	kJ/mol	Relay (1.0) Calculated Property
IE	9.19	eV	Relay (1.0) Calculated Property
log10WS	-5.80		Relay (1.0) Calculated Property
logPoct/wat	4.415		Crippen Calculated Property
McVol	175.640	ml/mol	McGowan Calculated Property
Pc	1870.79	kPa	Joback Calculated Property
I	[1246.00; 1246.00]
I	1246.00		NIST
I	1246.00		NIST
Tboil	463.84	K	Relay (1.0) Calculated Property
Tc	632.01	K	Relay (1.0) Calculated Property
Tfus	210.76	K	Relay (1.0) Calculated Property
Vc	0.639	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[249.61; 610.98]	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			-1.43750e+01
Coefficient B			1.13566e+00
Coefficient C			-6.58300e-04
Coefficient D			1.48000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	249.61	J/mol×K	273.00	Calculated Property
Cp,gas	311.56	J/mol×K	353.78	Calculated Property
Cp,gas	366.96	J/mol×K	434.56	Calculated Property
Cp,gas	416.30	J/mol×K	515.33	Calculated Property
Cp,gas	460.03	J/mol×K	596.11	Calculated Property
Cp,gas	498.62	J/mol×K	676.89	Calculated Property
Cp,gas	532.55	J/mol×K	757.67	Calculated Property
Cp,gas	562.27	J/mol×K	838.44	Calculated Property
Cp,gas	588.26	J/mol×K	919.22	Calculated Property
Cp,gas	610.98	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0161289; 0.0002248]	Pa×s	[193.24; 448.52]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.16351e+01
Coefficient B			1.45084e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			193.24
Temperature range, max.			448.52
η	0.0161289	Pa×s	193.24	Calculated Property
η	0.0061695	Pa×s	221.60	Calculated Property
η	0.0029350	Pa×s	249.97	Calculated Property
η	0.0016246	Pa×s	278.33	Calculated Property
η	0.0010032	Pa×s	306.70	Calculated Property
η	0.0006721	Pa×s	335.06	Calculated Property
η	0.0004794	Pa×s	363.43	Calculated Property
η	0.0003591	Pa×s	391.79	Calculated Property
η	0.0002796	Pa×s	420.16	Calculated Property
η	0.0002248	Pa×s	448.52	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[362.52; 508.90]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.52108e+01
Coefficient B			-4.30452e+03
Coefficient C			-7.40760e+01
Temperature range, min.			362.52
Temperature range, max.			508.90
Pvap	1.33	kPa	362.52	Calculated Property
Pvap	2.96	kPa	378.78	Calculated Property
Pvap	6.05	kPa	395.05	Calculated Property
Pvap	11.55	kPa	411.31	Calculated Property
Pvap	20.78	kPa	427.58	Calculated Property
Pvap	35.50	kPa	443.84	Calculated Property
Pvap	57.98	kPa	460.11	Calculated Property
Pvap	91.00	kPa	476.37	Calculated Property
Pvap	137.92	kPa	492.64	Calculated Property
Pvap	202.63	kPa	508.90	Calculated Property

Similar Compounds

Find more compounds similar to 1-Decene, 3,4-dimethyl-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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