Chemical Properties of Benzeneacetic acid, «alpha»-[[(trimethylsilyl)oxy]methyl]-, 9-methyl-3-oxa-9-azatricyclo[3.3.1.0(2,4)]non-7-yl ester, [7(S)-(1«alpha»,2«beta»,4«beta»,5«alpha»,7«beta»)]- (CAS 55373-83-6)

InChI

InChI=1S/C20H29NO4Si/c1-21-16-10-14(11-17(21)19-18(16)25-19)24-20(22)15(12-23-26(2,3)4)13-8-6-5-7-9-13/h5-9,14-19H,10-12H2,1-4H3

InChI Key

KYAGWQUTVDHVGQ-UHFFFAOYSA-N

Formula

C20H29NO4Si

SMILES

CN1C2CC(OC(=O)C(CO[Si](C)(C)C)c3ccccc3)CC1C1OC12

Molecular Weight¹

375.53

CAS

55373-83-6

Other Names

• Scopolamine hydrobromide, trimethylsilyl ether

• 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

Similar Compounds

Find more compounds similar to Benzeneacetic acid, «alpha»-[[(trimethylsilyl)oxy]methyl]-, 9-methyl-3-oxa-9-azatricyclo[3.3.1.0(2,4)]non-7-yl ester, [7(S)-(1«alpha»,2«beta»,4«beta»,5«alpha»,7«beta»)]-.

Sources

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• Crippen Method
• Crippen Method
• NIST Webbook

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