Chemical Properties of Alpha-monopropionin (CAS 624-47-5)

InChI

InChI=1S/C6H12O4/c1-2-6(9)10-4-5(8)3-7/h5,7-8H,2-4H2,1H3

InChI Key

AALUCPRYHRPMAG-UHFFFAOYSA-N

Formula

C6H12O4

SMILES

CCC(=O)OCC(O)CO

Molecular Weight¹

148.16

CAS

624-47-5

Other Names

• 1-Mono propionin
• (dl) glycerol 1-propionate

• 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).
• 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).
• 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

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[173.79; 374.86]	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			3.17430e+01
Coefficient B			5.92920e-01
Coefficient C			-2.72000e-04
Coefficient D			2.22000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	173.79	J/mol×K	273.00	Calculated Property
Cp,gas	208.44	J/mol×K	353.78	Calculated Property
Cp,gas	239.86	J/mol×K	434.56	Calculated Property
Cp,gas	268.10	J/mol×K	515.33	Calculated Property
Cp,gas	293.24	J/mol×K	596.11	Calculated Property
Cp,gas	315.34	J/mol×K	676.89	Calculated Property
Cp,gas	334.49	J/mol×K	757.67	Calculated Property
Cp,gas	350.75	J/mol×K	838.44	Calculated Property
Cp,gas	364.18	J/mol×K	919.22	Calculated Property
Cp,gas	374.86	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0532210; 0.0000897]	Pa×s	[306.35; 521.50]	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			-1.84127e+01
Coefficient B			4.74212e+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.			306.35
Temperature range, max.			521.50
η	0.0532210	Pa×s	306.35	Calculated Property
η	0.0173565	Pa×s	330.26	Calculated Property
η	0.0065847	Pa×s	354.16	Calculated Property
η	0.0028238	Pa×s	378.07	Calculated Property
η	0.0013393	Pa×s	401.97	Calculated Property
η	0.0006907	Pa×s	425.88	Calculated Property
η	0.0003822	Pa×s	449.78	Calculated Property
η	0.0002245	Pa×s	473.69	Calculated Property
η	0.0001388	Pa×s	497.60	Calculated Property
η	0.0000897	Pa×s	521.50	Calculated Property

Similar Compounds

Find more compounds similar to Alpha-monopropionin.

Sources

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

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