Chemical Properties of L-fucose, acetylated diethyldithioacetal derivative

InChI

InChI=1S/C18H30O8S2/c1-8-27-18(28-9-2)17(26-14(7)22)16(25-13(6)21)15(24-12(5)20)10(3)23-11(4)19/h10,15-18H,8-9H2,1-7H3/t10-,15+,16+,17-/m1/s1

InChI Key

IGZAPMUTZWRKTE-OOOSANSDSA-N

Formula

C18H30O8S2

SMILES

CCSC(SCC)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(C)OC(C)=O

Molecular Weight¹

438.56

• 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).
• 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
ΔfG°	-780.96	kJ/mol	Joback Calculated Property
ΔfH°gas	-1336.71	kJ/mol	Joback Calculated Property
ΔfusH°	44.17	kJ/mol	Joback Calculated Property
ΔvapH°	103.98	kJ/mol	Joback Calculated Property
log10WS	-3.63		Crippen Calculated Property
logPoct/wat	2.565		Crippen Calculated Property
McVol	326.940	ml/mol	McGowan Calculated Property
Pc	1384.02	kPa	Joback Calculated Property
Inp	[2252.00; 2252.00]
Inp	2252.00		NIST
Inp	2252.00		NIST
Tboil	1051.76	K	Joback Calculated Property
Tc	1288.34	K	Joback Calculated Property
Tfus	575.06	K	Joback Calculated Property
Vc	1.218	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1047.17; 1063.42]	J/mol×K	[1051.76; 1288.34]
Cp,gas	1047.17	J/mol×K	1051.76	Joback Calculated Property
Cp,gas	1054.69	J/mol×K	1091.19	Joback Calculated Property
Cp,gas	1059.93	J/mol×K	1130.62	Joback Calculated Property
Cp,gas	1062.86	J/mol×K	1170.05	Joback Calculated Property
Cp,gas	1063.42	J/mol×K	1209.48	Joback Calculated Property
Cp,gas	1061.59	J/mol×K	1248.91	Joback Calculated Property
Cp,gas	1057.31	J/mol×K	1288.34	Joback Calculated Property

Similar Compounds

Find more compounds similar to L-fucose, acetylated diethyldithioacetal derivative.

Sources

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

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