Chemical Properties of 1-Dodecen-3-ol, 3,7,11-trimethyl (CAS 3625-46-5)

InChI

InChI=1S/C15H30O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,13-14,16H,1,7-12H2,2-5H3

InChI Key

XLIJOVLDKFATNT-UHFFFAOYSA-N

Formula

C15H30O

SMILES

C=CC(C)(O)CCCC(C)CCCC(C)C

Molecular Weight¹

226.40

CAS

3625-46-5

• 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.
• 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	0.7561		Relay (... Calculated Property
ΔfG°	24.40	kJ/mol	Joback Calculated Property
ΔfH°gas	-460.82	kJ/mol	Relay (... Calculated Property
ΔfusH°	22.95	kJ/mol	Joback Calculated Property
ΔvapH°	78.84	kJ/mol	Relay (... Calculated Property
IE	9.48	eV	Relay (... Calculated Property
log10WS	-4.68		Relay (... Calculated Property
logPoct/wat	4.556		Crippen Calculated Property
McVol	223.780	ml/mol	McGowan Calculated Property
Pc	1614.17	kPa	Joback Calculated Property
Inp	1504.00		NIST
I	[1808.00; 1808.00]
I	1808.00		NIST
I	1808.00		NIST
Tboil	542.42	K	Relay (... Calculated Property
Tc	709.38	K	Relay (... Calculated Property
Tfus	271.28	K	Relay (... Calculated Property
Vc	0.814	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[617.86; 707.88]	J/mol×K	[627.35; 797.94]
Cp,gas	617.86	J/mol×K	627.35	Joback Calculated Property
Cp,gas	634.77	J/mol×K	655.78	Joback Calculated Property
Cp,gas	650.87	J/mol×K	684.21	Joback Calculated Property
Cp,gas	666.19	J/mol×K	712.64	Joback Calculated Property
Cp,gas	680.78	J/mol×K	741.07	Joback Calculated Property
Cp,gas	694.66	J/mol×K	769.50	Joback Calculated Property
Cp,gas	707.88	J/mol×K	797.94	Joback Calculated Property
η	[0.0000403; 0.0375017]	Pa×s	[290.29; 627.35]
η	0.0375017	Pa×s	290.29	Joback Calculated Property
η	0.0047655	Pa×s	346.47	Joback Calculated Property
η	0.0010769	Pa×s	402.64	Joback Calculated Property
η	0.0003503	Pa×s	458.82	Joback Calculated Property
η	0.0001456	Pa×s	515.00	Joback Calculated Property
η	0.0000719	Pa×s	571.17	Joback Calculated Property
η	0.0000403	Pa×s	627.35	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Dodecen-3-ol, 3,7,11-trimethyl.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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