Chemical Properties of L-(+)-Threose, tris(trifluoroacetate), methyloxime (anti)

InChI

InChI=1S/C11H8F9NO7/c1-25-21-2-4(27-7(23)10(15,16)17)5(28-8(24)11(18,19)20)3-26-6(22)9(12,13)14/h2,4-5H,3H2,1H3

InChI Key

LXLUTTKJBAJCOL-UHFFFAOYSA-N

Formula

C11H8F9NO7

SMILES

CON=CC(OC(=O)C(F)(F)F)C(COC(=O)C(F)(F)F)OC(=O)C(F)(F)F

Molecular Weight¹

437.17

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-2856.57	kJ/mol	Joback Calculated Property
ΔvapH°	61.26	kJ/mol	Joback Calculated Property
log10WS	-2.47		Crippen Calculated Property
logPoct/wat	1.672		Crippen Calculated Property
McVol	215.650	ml/mol	McGowan Calculated Property
Pc	1490.74	kPa	Joback Calculated Property
Inp	[1031.30; 1031.30]
Inp	1031.30		NIST
Inp	1031.30		NIST
Tboil	761.91	K	Joback Calculated Property
Tc	939.63	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to L-(+)-Threose, tris(trifluoroacetate), methyloxime (anti).

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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