Chemical Properties of d-Mannose, 2,3,4,5,6-pentakis-O-(trimethylsilyl)-, o-methyloxyme, (1Z)- (CAS 128705-67-9)

InChI

InChI=1S/C22H55NO6Si5/c1-24-23-17-19(26-31(5,6)7)21(28-33(11,12)13)22(29-34(14,15)16)20(27-32(8,9)10)18-25-30(2,3)4/h17,19-22H,18H2,1-16H3

InChI Key

LLVFXXKDPAPSCJ-UHFFFAOYSA-N

Formula

C22H55NO6Si5

SMILES

CON=CC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO[Si](C)(C)C)O[Si](C)(C)C

Molecular Weight¹

570.10

CAS

128705-67-9

Other Names

• D-(+)-Mannose, pentakis(trimethylsilyl) ether, methyloxime (syn)

• 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.
• 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	0.8703		Relay (1.0) Calculated Property
ΔfG°	-309.45	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-1514.56	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	76.39	kJ/mol	Relay (1.0) Calculated Property
IE	9.00	eV	Relay (1.0) Calculated Property
log10WS	-3.17		Relay (1.0) Calculated Property
logPoct/wat	6.351		Crippen Calculated Property
Inp	[1872.10; 1872.10]
Inp	1872.10		NIST
Inp	1872.10		NIST
Tboil	623.25	K	Relay (1.0) Calculated Property
Tc	746.24	K	Relay (1.0) Calculated Property
Tfus	294.97	K	Relay (1.0) Calculated Property
Vc	1.876	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to d-Mannose, 2,3,4,5,6-pentakis-O-(trimethylsilyl)-, o-methyloxyme, (1Z)-.

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
• NIST Webbook

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