Chemical Properties of 2-(2,5-Dimethoxy-4-ethylphenyl)ethanol, acetate

InChI

InChI=1S/C14H20O4/c1-5-11-8-14(17-4)12(9-13(11)16-3)6-7-18-10(2)15/h8-9H,5-7H2,1-4H3

InChI Key

KFQOLOALHKPWDS-UHFFFAOYSA-N

Formula

C14H20O4

SMILES

CCc1cc(OC)c(CCOC(C)=O)cc1OC

Molecular Weight¹

252.31

Other Names

• 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (desamino-HO-), acetylated

• 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°	-293.40	kJ/mol	Joback Calculated Property
ΔfH°gas	-639.41	kJ/mol	Joback Calculated Property
ΔfusH°	30.05	kJ/mol	Joback Calculated Property
ΔvapH°	65.00	kJ/mol	Joback Calculated Property
log10WS	-3.02		Crippen Calculated Property
logPoct/wat	2.372		Crippen Calculated Property
McVol	203.540	ml/mol	McGowan Calculated Property
Pc	1950.95	kPa	Joback Calculated Property
Inp	[1850.00; 1850.00]
Inp	1850.00		NIST
Inp	1850.00		NIST
Tboil	682.47	K	Joback Calculated Property
Tc	881.98	K	Joback Calculated Property
Tfus	428.14	K	Joback Calculated Property
Vc	0.771	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[547.11; 626.23]	J/mol×K	[682.47; 881.98]
Cp,gas	547.11	J/mol×K	682.47	Joback Calculated Property
Cp,gas	562.34	J/mol×K	715.72	Joback Calculated Property
Cp,gas	576.77	J/mol×K	748.97	Joback Calculated Property
Cp,gas	590.39	J/mol×K	782.23	Joback Calculated Property
Cp,gas	603.19	J/mol×K	815.48	Joback Calculated Property
Cp,gas	615.14	J/mol×K	848.73	Joback Calculated Property
Cp,gas	626.23	J/mol×K	881.98	Joback Calculated Property
η	[0.0000913; 0.0005786]	Pa×s	[428.14; 682.47]
η	0.0005786	Pa×s	428.14	Joback Calculated Property
η	0.0003703	Pa×s	470.53	Joback Calculated Property
η	0.0002552	Pa×s	512.92	Joback Calculated Property
η	0.0001861	Pa×s	555.31	Joback Calculated Property
η	0.0001419	Pa×s	597.69	Joback Calculated Property
η	0.0001122	Pa×s	640.08	Joback Calculated Property
η	0.0000913	Pa×s	682.47	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-(2,5-Dimethoxy-4-ethylphenyl)ethanol, acetate.

Sources

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

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