Chemical Properties of Glycolaldehyde dimer, chlorodifluoroacetate, trifluoroacetate

InChI

InChI=1S/C8H6ClF5O6/c9-7(10,11)5(15)19-3-1-18-4(2-17-3)20-6(16)8(12,13)14/h3-4H,1-2H2

InChI Key

NVZOFFIZBIGISG-UHFFFAOYSA-N

Formula

C8H6ClF5O6

SMILES

O=C(OC1COC(OC(=O)C(F)(F)Cl)CO1)C(F)(F)F

Molecular Weight¹

328.57

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ω	0.5026		Relay (1.0) Calculated Property
ΔfG°	-1587.16	kJ/mol	Joback Calculated Property
ΔfH°gas	-2062.91	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	35.68	kJ/mol	Joback Calculated Property
ΔvapH°	75.18	kJ/mol	Relay (1.0) Calculated Property
IE	11.33	eV	Relay (1.0) Calculated Property
log10WS	-2.79		Relay (1.0) Calculated Property
logPoct/wat	1.166		Crippen Calculated Property
McVol	160.430	ml/mol	McGowan Calculated Property
Pc	2592.49	kPa	Joback Calculated Property
Inp	[1182.00; 1182.00]
Inp	1182.00		NIST
Inp	1182.00		NIST
Tboil	463.56	K	Relay (1.0) Calculated Property
Tc	637.19	K	Relay (1.0) Calculated Property
Tfus	290.10	K	Relay (1.0) Calculated Property
Vc	0.639	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[442.61; 497.60]	J/mol×K	[631.12; 825.93]
Cp,gas	442.61	J/mol×K	631.12	Joback Calculated Property
Cp,gas	453.79	J/mol×K	663.59	Joback Calculated Property
Cp,gas	464.13	J/mol×K	696.06	Joback Calculated Property
Cp,gas	473.66	J/mol×K	728.52	Joback Calculated Property
Cp,gas	482.40	J/mol×K	760.99	Joback Calculated Property
Cp,gas	490.38	J/mol×K	793.46	Joback Calculated Property
Cp,gas	497.60	J/mol×K	825.93	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycolaldehyde dimer, chlorodifluoroacetate, trifluoroacetate.

Sources

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

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