Chemical Properties of Galactopyranoside, p-nitrophenyl, tetraacetate, beta-d- (CAS 2872-66-4)

InChI

InChI=1S/C20H23NO12/c1-10(22)28-9-16-17(29-11(2)23)18(30-12(3)24)19(31-13(4)25)20(33-16)32-15-7-5-14(6-8-15)21(26)27/h5-8,16-20H,9H2,1-4H3/t16-,17+,18+,19-,20-/m1/s1

InChI Key

BEUISCKWILNFIL-LCWAXJCOSA-N

Formula

C20H23NO12

SMILES

CC(=O)OCC1OC(Oc2ccc([N+](=O)[O-])cc2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Molecular Weight¹

469.40

CAS

2872-66-4

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1006.61; 1071.80]	J/mol×K	[1123.82; 1376.69]
Cp,gas	1071.80	J/mol×K	1123.82	Joback Calculated Property
Cp,gas	1069.86	J/mol×K	1165.97	Joback Calculated Property
Cp,gas	1064.44	J/mol×K	1208.11	Joback Calculated Property
Cp,gas	1055.47	J/mol×K	1250.26	Joback Calculated Property
Cp,gas	1042.89	J/mol×K	1292.40	Joback Calculated Property
Cp,gas	1026.63	J/mol×K	1334.55	Joback Calculated Property
Cp,gas	1006.61	J/mol×K	1376.69	Joback Calculated Property

Similar Compounds

Find more compounds similar to Galactopyranoside, p-nitrophenyl, tetraacetate, beta-d-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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