Chemical Properties of Cytosine arabinoside, dimethyl-propyldimethylsilyl derivative

InChI

InChI=1S/C29H61N3O5Si4/c1-13-19-38(5,6)31-25-17-18-32(29(33)30-25)28-27(37-41(11,12)22-16-4)26(36-40(9,10)21-15-3)24(35-28)23-34-39(7,8)20-14-2/h17-18,24,26-28H,13-16,19-23H2,1-12H3,(H,30,31,33)/t24-,26-,27+,28-/m1/s1

InChI Key

AMNVPIMMQLSVBF-AOGFTHLWSA-N

Formula

C29H61N3O5Si4

SMILES

CCC[Si](C)(C)Nc1ccn(C2OC(CO[Si](C)(C)CCC)C(O[Si](C)(C)CCC)C2O[Si](C)(C)CCC)c(=O)n1

Molecular Weight¹

644.15

• 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.
• 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	1.1083		Relay (... Calculated Property
ΔfG°	-108.72	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-1407.17	kJ/mol	Relay (... Calculated Property
ΔvapH°	131.74	kJ/mol	Relay (... Calculated Property
IE	8.33	eV	Relay (... Calculated Property
log10WS	-5.99		Relay (... Calculated Property
logPoct/wat	7.800		Crippen Calculated Property
Pc	-145.74	kPa	Relay (... Calculated Property ⚠️
Inp	[2896.00; 2896.00]
Inp	2896.00		NIST
Inp	2896.00		NIST
Tboil	747.91	K	Relay (... Calculated Property
Tc	975.99	K	Relay (... Calculated Property
Tfus	319.60	K	Relay (... Calculated Property
Vc	2.041	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to Cytosine arabinoside, dimethyl-propyldimethylsilyl derivative.

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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