Chemical Properties of «alpha»-D-Mannopyranoside, 1-cyclohexyl, permethylated

InChI

InChI=1S/C16H30O6/c1-17-10-12-13(18-2)14(19-3)15(20-4)16(22-12)21-11-8-6-5-7-9-11/h11-16H,5-10H2,1-4H3/t12-,13-,14+,15+,16+/m1/s1

InChI Key

KBMAHMXTIVYWOQ-OWYFMNJBSA-N

Formula

C16H30O6

SMILES

COCC1OC(OC2CCCCC2)C(OC)C(OC)C1OC

Molecular Weight¹

318.41

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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°	-509.22	kJ/mol	Joback Calculated Property
ΔfH°gas	-1139.39	kJ/mol	Joback Calculated Property
ΔfusH°	39.07	kJ/mol	Joback Calculated Property
ΔvapH°	67.39	kJ/mol	Joback Calculated Property
log10WS	-2.00		Crippen Calculated Property
logPoct/wat	1.752		Crippen Calculated Property
McVol	249.800	ml/mol	McGowan Calculated Property
Pc	1514.03	kPa	Joback Calculated Property
Inp	[1897.00; 1897.00]
Inp	1897.00		NIST
Inp	1897.00		NIST
Tboil	724.95	K	Joback Calculated Property
Tc	928.67	K	Joback Calculated Property
Tfus	405.60	K	Joback Calculated Property
Vc	0.904	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[809.66; 927.04]	J/mol×K	[724.95; 928.67]
Cp,gas	809.66	J/mol×K	724.95	Joback Calculated Property
Cp,gas	833.22	J/mol×K	758.90	Joback Calculated Property
Cp,gas	855.24	J/mol×K	792.86	Joback Calculated Property
Cp,gas	875.68	J/mol×K	826.81	Joback Calculated Property
Cp,gas	894.49	J/mol×K	860.77	Joback Calculated Property
Cp,gas	911.62	J/mol×K	894.72	Joback Calculated Property
Cp,gas	927.04	J/mol×K	928.67	Joback Calculated Property
η	[0.0000968; 0.0007721]	Pa×s	[405.60; 724.95]
η	0.0007721	Pa×s	405.60	Joback Calculated Property
η	0.0004469	Pa×s	458.83	Joback Calculated Property
η	0.0002898	Pa×s	512.05	Joback Calculated Property
η	0.0002039	Pa×s	565.28	Joback Calculated Property
η	0.0001524	Pa×s	618.50	Joback Calculated Property
η	0.0001193	Pa×s	671.73	Joback Calculated Property
η	0.0000968	Pa×s	724.95	Joback Calculated Property

Similar Compounds

Find more compounds similar to «alpha»-D-Mannopyranoside, 1-cyclohexyl, permethylated.

Sources

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

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