Chemical Properties of 1-Undecen-3-ol (CAS 35329-42-1)

InChI

InChI=1S/C11H22O/c1-3-5-6-7-8-9-10-11(12)4-2/h4,11-12H,2-3,5-10H2,1H3

InChI Key

NAOMHUDQUVEWEF-UHFFFAOYSA-N

Formula

C11H22O

SMILES

C=CC(O)CCCCCCCC

Molecular Weight¹

170.29

CAS

35329-42-1

Other Names

• undec-1-en-3-ol

• 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).
• 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
ω	0.7105		Relay (1.0) Calculated Property
ΔfG°	-9.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-342.73	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.53	kJ/mol	Joback Calculated Property
ΔvapH°	74.17	kJ/mol	Relay (1.0) Calculated Property
IE	9.57	eV	Relay (1.0) Calculated Property
log10WS	-3.26		Relay (1.0) Calculated Property
logPoct/wat	3.284		Crippen Calculated Property
McVol	167.420	ml/mol	McGowan Calculated Property
Pc	2200.01	kPa	Joback Calculated Property
Inp	[1293.00; 1293.00]
Inp	1293.00		NIST
Inp	1293.00		NIST
Tboil	498.11	K	Relay (1.0) Calculated Property
Tc	676.53	K	Relay (1.0) Calculated Property
Tfus	281.23	K	Relay (1.0) Calculated Property
Vc	0.632	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[241.21; 577.53]	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			-6.49300e+00
Coefficient B			1.06872e+00
Coefficient C			-6.31100e-04
Coefficient D			1.46400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	241.21	J/mol×K	273.00	Calculated Property
Cp,gas	299.09	J/mol×K	353.78	Calculated Property
Cp,gas	350.76	J/mol×K	434.56	Calculated Property
Cp,gas	396.69	J/mol×K	515.33	Calculated Property
Cp,gas	437.33	J/mol×K	596.11	Calculated Property
Cp,gas	473.16	J/mol×K	676.89	Calculated Property
Cp,gas	504.63	J/mol×K	757.67	Calculated Property
Cp,gas	532.20	J/mol×K	838.44	Calculated Property
Cp,gas	556.35	J/mol×K	919.22	Calculated Property
Cp,gas	577.53	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0477904; 0.0001747]	Pa×s	[257.79; 492.05]	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			-1.48275e+01
Coefficient B			3.03845e+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.			257.79
Temperature range, max.			492.05
η	0.0477904	Pa×s	257.79	Calculated Property
η	0.0162142	Pa×s	283.82	Calculated Property
η	0.0065967	Pa×s	309.85	Calculated Property
η	0.0030852	Pa×s	335.88	Calculated Property
η	0.0016096	Pa×s	361.91	Calculated Property
η	0.0009164	Pa×s	387.93	Calculated Property
η	0.0005600	Pa×s	413.96	Calculated Property
η	0.0003628	Pa×s	439.99	Calculated Property
η	0.0002467	Pa×s	466.02	Calculated Property
η	0.0001747	Pa×s	492.05	Calculated Property

Similar Compounds

Find more compounds similar to 1-Undecen-3-ol.

Sources

• Cheméo Relay (1.0)
• 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.
These property values are available through the Cheméo API. A free account gives you an access key.