Chemical Properties of 1-(4-Methoxyphenyl)propane-1,2-diol (CAS 51410-48-1)

InChI

InChI=1S/C10H14O3/c1-7(11)10(12)8-3-5-9(13-2)6-4-8/h3-7,10-12H,1-2H3

InChI Key

MRDZSBVJWOXBRW-UHFFFAOYSA-N

Formula

C10H14O3

SMILES

COc1ccc(C(O)C(C)O)cc1

Molecular Weight¹

182.22

CAS

51410-48-1

• 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°	-247.42	kJ/mol	Joback Calculated Property
ΔfH°gas	-471.91	kJ/mol	Joback Calculated Property
ΔfusH°	17.63	kJ/mol	Joback Calculated Property
ΔvapH°	75.78	kJ/mol	Joback Calculated Property
log10WS	-1.91		Crippen Calculated Property
logPoct/wat	1.109		Crippen Calculated Property
McVol	145.610	ml/mol	McGowan Calculated Property
Pc	3547.31	kPa	Joback Calculated Property
Inp	[1582.30; 1582.30]
Inp	1582.30		NIST
Inp	1582.30		NIST
Tboil	665.76	K	Joback Calculated Property
Tc	854.92	K	Joback Calculated Property
Tfus	355.27	K	Joback Calculated Property
Vc	0.531	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[386.88; 441.35]	J/mol×K	[665.76; 854.92]
Cp,gas	386.88	J/mol×K	665.76	Joback Calculated Property
Cp,gas	397.35	J/mol×K	697.29	Joback Calculated Property
Cp,gas	407.25	J/mol×K	728.81	Joback Calculated Property
Cp,gas	416.58	J/mol×K	760.34	Joback Calculated Property
Cp,gas	425.37	J/mol×K	791.86	Joback Calculated Property
Cp,gas	433.62	J/mol×K	823.39	Joback Calculated Property
Cp,gas	441.35	J/mol×K	854.92	Joback Calculated Property
η	[0.0000133; 0.0079564]	Pa×s	[355.27; 665.76]
η	0.0079564	Pa×s	355.27	Joback Calculated Property
η	0.0013920	Pa×s	407.02	Joback Calculated Property
η	0.0003609	Pa×s	458.77	Joback Calculated Property
η	0.0001230	Pa×s	510.51	Joback Calculated Property
η	0.0000511	Pa×s	562.26	Joback Calculated Property
η	0.0000246	Pa×s	614.01	Joback Calculated Property
η	0.0000133	Pa×s	665.76	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-(4-Methoxyphenyl)propane-1,2-diol.

Sources

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

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