Chemical Properties of Pseudo uridine penta-tms (CAS 53294-25-0)

InChI

InChI=1S/C24H52N2O6Si5/c1-33(2,3)27-17-19-21(29-34(4,5)6)22(30-35(7,8)9)20(28-19)18-16-25-24(32-37(13,14)15)26-23(18)31-36(10,11)12/h16,19-22H,17H2,1-15H3

InChI Key

XHLZQKAETJELAB-UHFFFAOYSA-N

Formula

C24H52N2O6Si5

SMILES

C[Si](C)(C)OCC1OC(c2cnc(O[Si](C)(C)C)nc2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C

Molecular Weight¹

605.11

CAS

53294-25-0

Other Names

• «beta»-Pseudouridine, TMS

• 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	0.8864		Relay (1.0) Calculated Property
ΔfG°	-241.42	kJ/mol	Relay (1.0-beta) Calculated Property ⚠️
ΔfH°gas	-1545.10	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	91.56	kJ/mol	Relay (1.0) Calculated Property
IE	9.27	eV	Relay (1.0) Calculated Property
log10WS	-3.96		Relay (1.0) Calculated Property
logPoct/wat	6.636		Crippen Calculated Property
Pc	-384.14	kPa	Relay (1.0-beta) Calculated Property ⚠️
Inp	[2375.00; 2375.00]
Inp	2375.00		NIST
Inp	2375.00		NIST
Tboil	666.88	K	Relay (1.0) Calculated Property
Tc	891.06	K	Relay (1.0) Calculated Property
Tfus	314.60	K	Relay (1.0) Calculated Property
Vc	1.946	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Pseudo uridine penta-tms.

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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