Chemical Properties of Butanedioic acid, 2,3-dihydroxy- [R-(R*,R*)]-, dimethyl ester (CAS 608-68-4)

InChI

InChI=1S/C6H10O6/c1-11-5(9)3(7)4(8)6(10)12-2/h3-4,7-8H,1-2H3/t3-,4-/m0/s1

InChI Key

PVRATXCXJDHJJN-IMJSIDKUSA-N

Formula

C6H10O6

SMILES

COC(=O)C(O)C(O)C(=O)OC

Molecular Weight¹

178.14

CAS

608-68-4

Other Names

• Tartaric acid, dimethyl ester, (+)-
• Dimethyl (+)-tartrate
• Dimethyl d-tartrate
• Dimethyl tartrate
• Dimethyl L-tartrate
• l-Tartaric acid, dimethyl ester
• L-(+)-Tartaric acid, dimethyl ester
• Butanedioic acid, 2,3-dihydroxy- (2R,3R)-, 1,4-dimethyl ester
• NSC 517
• Dimethyl 2,3-dihydroxysuccinate
• dimethyl [R(R*,R*)]-tartrate

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
ΔfusH	17.36	kJ/mol	322.20	NIST
ΔsubH	77.00 ± 8.00	kJ/mol	315.00	NIST
ΔvapH	[66.00; 76.40]	kJ/mol	[343.50; 464.00]
ΔvapH	76.40	kJ/mol	343.50	NIST
ΔvapH	66.00	kJ/mol	464.00	NIST

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[189.81; 383.51]	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			5.54700e+01
Coefficient B			5.44040e-01
Coefficient C			-1.80600e-04
Coefficient D			-3.54000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	189.81	J/mol×K	273.00	Calculated Property
Cp,gas	223.77	J/mol×K	353.78	Calculated Property
Cp,gas	254.88	J/mol×K	434.56	Calculated Property
Cp,gas	283.03	J/mol×K	515.33	Calculated Property
Cp,gas	308.10	J/mol×K	596.11	Calculated Property
Cp,gas	330.00	J/mol×K	676.89	Calculated Property
Cp,gas	348.60	J/mol×K	757.67	Calculated Property
Cp,gas	363.79	J/mol×K	838.44	Calculated Property
Cp,gas	375.47	J/mol×K	919.22	Calculated Property
Cp,gas	383.51	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0263427; 0.0000445]	Pa×s	[333.68; 567.53]	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			-1.91294e+01
Coefficient B			5.16966e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			333.68
Temperature range, max.			567.53
η	0.0263427	Pa×s	333.68	Calculated Property
η	0.0086016	Pa×s	359.66	Calculated Property
η	0.0032658	Pa×s	385.65	Calculated Property
η	0.0014012	Pa×s	411.63	Calculated Property
η	0.0006648	Pa×s	437.61	Calculated Property
η	0.0003429	Pa×s	463.60	Calculated Property
η	0.0001897	Pa×s	489.58	Calculated Property
η	0.0001114	Pa×s	515.56	Calculated Property
η	0.0000689	Pa×s	541.54	Calculated Property
η	0.0000445	Pa×s	567.53	Calculated Property

Similar Compounds

Find more compounds similar to Butanedioic acid, 2,3-dihydroxy- [R-(R*,R*)]-, dimethyl ester.

Sources

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

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