Chemical Properties of Phosphoric acid, tris(2,2-dimethylpentyl) ester (CAS 116402-18-7)

InChI

InChI=1S/C21H45O4P/c1-10-13-19(4,5)16-23-26(22,24-17-20(6,7)14-11-2)25-18-21(8,9)15-12-3/h10-18H2,1-9H3

InChI Key

WEDRSNCKSZVNAJ-UHFFFAOYSA-N

Formula

C21H45O4P

SMILES

CCCC(C)(C)COP(=O)(OCC(C)(C)CCC)OCC(C)(C)CCC

Molecular Weight¹

392.55

CAS

116402-18-7

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation 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).
• 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

Similar Compounds

Find more compounds similar to Phosphoric acid, tris(2,2-dimethylpentyl) ester.

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
• McGowan Method
• NIST Webbook

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