Chemical Properties of [2H2]malonic [2H2]acid (CAS 813-56-9)

InChI

InChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)/i1D2/hD2

InChI Key

OFOBLEOULBTSOW-BGOGGDMHSA-N

Formula

C3D4O4

SMILES

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

Molecular Weight¹

108.09

CAS

813-56-9

Other Names

• Malonic acid-d4

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,solid : Solid phase 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).
• S°_{solid,1 bar} : Solid phase molar entropy at standard conditions (J/mol×K).
• 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	[96.37; 195.66]	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			9.36100e+00
Coefficient B			3.90400e-01
Coefficient C			-2.84600e-04
Coefficient D			8.05000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	96.37	J/mol×K	273.00	Calculated Property
Cp,gas	115.42	J/mol×K	353.78	Calculated Property
Cp,gas	131.87	J/mol×K	434.56	Calculated Property
Cp,gas	145.98	J/mol×K	515.33	Calculated Property
Cp,gas	158.00	J/mol×K	596.11	Calculated Property
Cp,gas	168.19	J/mol×K	676.89	Calculated Property
Cp,gas	176.79	J/mol×K	757.67	Calculated Property
Cp,gas	184.07	J/mol×K	838.44	Calculated Property
Cp,gas	190.27	J/mol×K	919.22	Calculated Property
Cp,gas	195.66	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0008078; 0.0003443]	Pa×s	[444.77; 541.07]	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			-1.19120e+01
Coefficient B			2.13080e+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.			444.77
Temperature range, max.			541.07
η	0.0008078	Pa×s	444.77	Calculated Property
η	0.0007218	Pa×s	455.47	Calculated Property
η	0.0006483	Pa×s	466.17	Calculated Property
η	0.0005851	Pa×s	476.87	Calculated Property
η	0.0005305	Pa×s	487.57	Calculated Property
η	0.0004829	Pa×s	498.27	Calculated Property
η	0.0004414	Pa×s	508.97	Calculated Property
η	0.0004050	Pa×s	519.67	Calculated Property
η	0.0003728	Pa×s	530.37	Calculated Property
η	0.0003443	Pa×s	541.07	Calculated Property

Similar Compounds

Find more compounds similar to [2H2]malonic [2H2]acid.

Sources

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

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