Chemical Properties of 1-Undecene (CAS 821-95-4)

InChI

InChI=1S/C11H22/c1-3-5-7-9-11-10-8-6-4-2/h3H,1,4-11H2,2H3

InChI Key

DCTOHCCUXLBQMS-UHFFFAOYSA-N

Formula

C11H22

SMILES

C=CCCCCCCCCC

Molecular Weight¹

154.29

CAS

821-95-4

Other Names

• Undec-1-ene
• Undecene-1
• n-1-Undecene
• «alpha»-Undecene

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase heat capacity (J/mol×K).
• C_sat : Molar heat capacity at saturation pressure (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_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• ρ_l : Liquid Density (kg/m³).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
• γ : Surface Tension (N/m).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• Z_c : Critical Compressibility.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.5180		KDB
ΔfG°	129.50	kJ/mol	KDB
ΔfH°gas	-144.90	kJ/mol	KDB
ΔfusH°	22.97	kJ/mol	Joback Calculated Property
ΔvapH°	[54.30; 55.40]	kJ/mol
ΔvapH°	54.30 ± 0.30	kJ/mol	NIST
ΔvapH°	55.40	kJ/mol	NIST
IE	9.38	eV	Relay (1.0) Calculated Property
log10WS	-5.80		Relay (1.0) Calculated Property
logPoct/wat	4.313		Crippen Calculated Property
McVol	161.550	ml/mol	McGowan Calculated Property
Pc	1990.00	kPa	KDB
Inp	[179.50; 1100.00]
Inp	1082.00		NIST
Inp	1087.00		NIST
Inp	1090.00		NIST
Inp	1089.00		NIST
Inp	1088.00		NIST
Inp	1090.00		NIST
Inp	1094.00		NIST
Inp	1082.00		NIST
Inp	1083.00		NIST
Inp	1084.00		NIST
Inp	1082.00		NIST
Inp	1089.90		NIST
Inp	1087.00		NIST
Inp	1090.00		NIST
Inp	1088.00		NIST
Inp	1090.00		NIST
Inp	1090.50		NIST
Inp	1093.00		NIST
Inp	1092.00		NIST
Inp	1088.00		NIST
Inp	1088.00		NIST
Inp	1092.00		NIST
Inp	1093.00		NIST
Inp	1090.90		NIST
Inp	1091.40		NIST
Inp	1091.40		NIST
Inp	1086.00		NIST
Inp	1090.90		NIST
Inp	1091.40		NIST
Inp	1091.40		NIST
Inp	1089.00		NIST
Inp	1088.00		NIST
Inp	1088.79		NIST
Inp	1088.78		NIST
Inp	1088.91		NIST
Inp	1091.72		NIST
Inp	1091.85		NIST
Inp	1092.00		NIST
Inp	1088.00		NIST
Inp	1092.00		NIST
Inp	1093.00		NIST
Inp	1093.00		NIST
Inp	1092.00		NIST
Inp	1089.00		NIST
Inp	1089.00		NIST
Inp	1091.00		NIST
Inp	1092.00		NIST
Inp	1092.00		NIST
Inp	1092.00		NIST
Inp	1091.00		NIST
Inp	1089.00		NIST
Inp	1095.00		NIST
Inp	1088.60		NIST
Inp	1089.00		NIST
Inp	1088.00		NIST
Inp	1092.00		NIST
Inp	1088.00		NIST
Inp	1097.00		NIST
Inp	1100.00		NIST
Inp	1086.00		NIST
Inp	1090.00		NIST
Inp	1092.00		NIST
Inp	1090.00		NIST
Inp	1082.00		NIST
Inp	1087.00		NIST
Inp	1089.00		NIST
Inp	1088.00		NIST
Inp	1084.00		NIST
Inp	1083.00		NIST
Inp	Outlier 179.50		NIST
Inp	1087.00		NIST
Inp	Outlier 179.50		NIST
Inp	1093.00		NIST
Inp	1090.90		NIST
Inp	1088.79		NIST
Inp	1092.00		NIST
Inp	1088.00		NIST
Inp	1095.00		NIST
I	[1135.00; 1160.00]
I	1151.00		NIST
I	1152.00		NIST
I	1154.00		NIST
I	1148.00		NIST
I	1146.00		NIST
I	1146.00		NIST
I	1146.00		NIST
I	1147.00		NIST
I	1145.00		NIST
I	1151.20		NIST
I	1153.60		NIST
I	1148.40		NIST
I	1151.20		NIST
I	1153.60		NIST
I	1148.40		NIST
I	1147.00		NIST
I	1135.00		NIST
I	1142.00		NIST
I	1141.00		NIST
I	Outlier 1160.00		NIST
I	1136.00		NIST
I	1139.00		NIST
I	1139.00		NIST
I	1138.00		NIST
I	1136.00		NIST
I	1135.00		NIST
S°liquid	456.56	J/mol×K	NIST
Tboil	[462.00; 470.87]	K
Tboil	465.80	K	KDB
Tboil	465.90	K	NIST
Tboil	462.00 ± 2.00	K	NIST
Tboil	462.00 ± 4.00	K	NIST
Tboil	465.86 ± 0.30	K	NIST
Tboil	465.50 ± 1.00	K	NIST
Tboil	465.85 ± 0.30	K	NIST
Tboil	470.87 ± 3.00	K	NIST
Tboil	470.00 ± 6.00	K	NIST
Tboil	462.00 ± 4.00	K	NIST
Tboil	466.00 ± 4.00	K	NIST
Tc	637.00	K	KDB
Tfus	[223.70; 224.00]	K
Tfus	224.00	K	KDB
Tfus	223.95 ± 0.50	K	NIST
Tfus	223.96 ± 0.05	K	NIST
Tfus	223.97 ± 0.03	K	NIST
Tfus	223.94 ± 0.05	K	NIST
Tfus	223.96 ± 0.03	K	NIST
Tfus	223.70 ± 2.00	K	NIST
Tfus	223.70 ± 0.50	K	NIST
Tfus	223.70 ± 1.50	K	NIST
Ttriple	[223.98; 223.99]	K
Ttriple	223.99 ± 0.01	K	NIST
Ttriple	223.98 ± 0.05	K	NIST
Ttriple	223.99 ± 0.01	K	NIST
Vc	0.632	m3/kmol	KDB
Zc	0.2376500		KDB

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,liquid	329.95	J/mol×K	298.15	NIST
Csat	[308.10; 335.90]	J/mol×K	[230.00; 310.00]
Csat	308.10	J/mol×K	230.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	308.60	J/mol×K	240.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	310.40	J/mol×K	250.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	313.30	J/mol×K	260.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	317.00	J/mol×K	270.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	318.30	J/mol×K	273.15	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	321.40	J/mol×K	280.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	326.20	J/mol×K	290.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	330.20	J/mol×K	298.15	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	331.10	J/mol×K	300.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	335.90	J/mol×K	310.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
ΔfusH	[9.20; 16.99]	kJ/mol	[217.30; 224.00]
ΔfusH	9.20	kJ/mol	217.30	NIST
ΔfusH	16.99	kJ/mol	224.00	NIST
ΔfusH	16.99	kJ/mol	224.00	NIST
ΔvapH	[40.88; 48.20]	kJ/mol	[425.50; 465.80]
ΔvapH	48.20	kJ/mol	425.50	NIST
ΔvapH	40.88	kJ/mol	465.80	KDB
ρl	751.00	kg/m3	293.00	KDB
ΔfusS	[42.36; 75.84]	J/mol×K	[217.30; 224.00]
ΔfusS	42.36	J/mol×K	217.30	NIST
ΔfusS	75.84	J/mol×K	224.00	NIST
γ	0.02	N/m	298.20	KDB

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[229.02; 558.32]	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			-1.01020e+01
Coefficient B			1.02882e+00
Coefficient C			-5.97500e-04
Coefficient D			1.37100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	229.02	J/mol×K	273.00	Calculated Property
Cp,gas	285.16	J/mol×K	353.78	Calculated Property
Cp,gas	335.40	J/mol×K	434.56	Calculated Property
Cp,gas	380.17	J/mol×K	515.33	Calculated Property
Cp,gas	419.91	J/mol×K	596.11	Calculated Property
Cp,gas	455.05	J/mol×K	676.89	Calculated Property
Cp,gas	486.03	J/mol×K	757.67	Calculated Property
Cp,gas	513.28	J/mol×K	838.44	Calculated Property
Cp,gas	537.23	J/mol×K	919.22	Calculated Property
Cp,gas	558.32	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0039541; 0.0002289]	Pa×s	[223.88; 445.90]	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			-1.12551e+01
Coefficient B			1.28104e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			223.88
Temperature range, max.			445.90
η	0.0039541	Pa×s	223.88	Calculated Property
η	0.0022407	Pa×s	248.54	Calculated Property
η	0.0014069	Pa×s	273.21	Calculated Property
η	0.0009542	Pa×s	297.88	Calculated Property
η	0.0006867	Pa×s	322.55	Calculated Property
η	0.0005179	Pa×s	347.22	Calculated Property
η	0.0004055	Pa×s	371.89	Calculated Property
η	0.0003273	Pa×s	396.56	Calculated Property
η	0.0002709	Pa×s	421.23	Calculated Property
η	0.0002289	Pa×s	445.90	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[345.26; 495.90]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.44919e+01
Coefficient B			-3.90995e+03
Coefficient C			-6.99970e+01
Temperature range, min.			345.26
Temperature range, max.			495.90
Pvap	1.33	kPa	345.26	Calculated Property
Pvap	3.01	kPa	362.00	Calculated Property
Pvap	6.22	kPa	378.74	Calculated Property
Pvap	11.93	kPa	395.47	Calculated Property
Pvap	21.46	kPa	412.21	Calculated Property
Pvap	36.57	kPa	428.95	Calculated Property
Pvap	59.41	kPa	445.69	Calculated Property
Pvap	92.61	kPa	462.42	Calculated Property
Pvap	139.20	kPa	479.16	Calculated Property
Pvap	202.65	kPa	495.90	Calculated Property
Pvap	[1.83e-05; 2036.33]	kPa	[223.99; 638.00]	KDB Vapor Pressure Data
Equation			ln(Y) = A + B/T + C·ln(T) + D·T² + E/T² Y is Pvap in kPa, T in K
Coefficient A			1.36979e+02
Coefficient B			-1.16219e+04
Coefficient C			-1.78317e+01
Coefficient D			9.87600e-06
Coefficient E			0.00000e+00
Temperature range, min.			223.99
Temperature range, max.			638.00
Pvap	1.83e-05	kPa	223.99	Calculated Property
Pvap	5.65e-03	kPa	269.99	Calculated Property
Pvap	0.23	kPa	315.99	Calculated Property
Pvap	3.03	kPa	361.99	Calculated Property
Pvap	19.03	kPa	407.99	Calculated Property
Pvap	75.09	kPa	454.00	Calculated Property
Pvap	218.40	kPa	500.00	Calculated Property
Pvap	518.24	kPa	546.00	Calculated Property
Pvap	1073.88	kPa	592.00	Calculated Property
Pvap	2036.33	kPa	638.00	Calculated Property
Pvap	[6.40; 104.02]	kPa	[379.02; 466.89]	NIST
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.40262e+01
Coefficient B			-3.59772e+03
Coefficient C			-8.34070e+01
Reference			Forziati, Camin, et al., 1950, 2
Temperature range, min.			379.02
Temperature range, max.			466.89
Pvap	6.40	kPa	379.02	Calculated Property
Pvap	9.44	kPa	388.78	Calculated Property
Pvap	13.60	kPa	398.55	Calculated Property
Pvap	19.16	kPa	408.31	Calculated Property
Pvap	26.47	kPa	418.07	Calculated Property
Pvap	35.90	kPa	427.84	Calculated Property
Pvap	47.88	kPa	437.60	Calculated Property
Pvap	62.88	kPa	447.36	Calculated Property
Pvap	81.41	kPa	457.13	Calculated Property
Pvap	104.02	kPa	466.89	Calculated Property
Pvap	[6.40; 104.02]	kPa	[379.02; 466.89]	NIST
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.40262e+01
Coefficient B			-3.59772e+03
Coefficient C			-8.34070e+01
Reference			Forziati, Camin, et al., 1950
Temperature range, min.			379.02
Temperature range, max.			466.89
Pvap	6.40	kPa	379.02	Calculated Property
Pvap	9.44	kPa	388.78	Calculated Property
Pvap	13.60	kPa	398.55	Calculated Property
Pvap	19.16	kPa	408.31	Calculated Property
Pvap	26.47	kPa	418.07	Calculated Property
Pvap	35.90	kPa	427.84	Calculated Property
Pvap	47.88	kPa	437.60	Calculated Property
Pvap	62.88	kPa	447.36	Calculated Property
Pvap	81.41	kPa	457.13	Calculated Property
Pvap	104.02	kPa	466.89	Calculated Property

Similar Compounds

Find more compounds similar to 1-Undecene.

Sources

• KDB Vapor Pressure Data
• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Infinite dilution activity coefficients, specific retention volumes and solvation thermodynamics of hydrocarbons in C78H158 branched alkane solvent
• Activity coefficients at infinite dilution of organic solutes in the ionic liquid 1-ethyl-3-methylimidazolium trifluoromethanesulfonate using gas liquid chromatography at T = (313.15, 323.15, and 333.15) K
• Thermodynamic Properties of Mixtures Containing Ionic Liquids. 5. Activity Coefficients at Infinite Dilution of Hydrocarbons, Alcohols, Esters, and Aldehydes in 1-Methyl-3-butyl-imidazolium Bis(trifluoromethyl-sulfonyl) Imide Using Gas-Liquid Chromatography
• Thermodynamic Properties of Mixtures Containing Ionic Liquids. 6. Activity Coefficients at Infinite Dilution of Hydrocarbons, Alcohols, Esters, and Aldehydes in 1-Methyl-3-octyl-imidazolium Tetrafluoroborate Using Gas-Liquid Chromatography
• Thermodynamic Properties of Mixtures Containing Ionic Liquids. 8. Activity Coefficients at Infinite Dilution of Hydrocarbons, Alcohols, Esters, and Aldehydes in 1-Hexyl-3-methylimidazolium Bis(trifluoromethylsulfonyl) Imide Using Gas-Liquid Chromatography
• Thermodynamic Properties of Mixtures Containing Ionic Liquids. 9. Activity Coefficients at Infinite Dilution of Hydrocarbons, Alcohols, Esters, and Aldehydes in Trimethyl-butylammonium Bis(trifluoromethylsulfonyl) Imide Using Gas-Liquid Chromatography and Static Method
• Joback Method
• KDB
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure
• Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD

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