[2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate

C10H22O4Si2 — CID 123576735

IUPAC[2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC(C[SiH2]CO)O[Si](C)(C)C
InChIInChI=1S/C10H22O4Si2/c1-8(2)10(12)13-9(6-15-7-11)14-16(3,4)5/h9,11H,1,6-7,15H2,2-5H3
InChIKeyWDNDUWFWLGVOSP-UHFFFAOYSA-N
MW262.45 g/mol
LogP0.82
Rot. Bonds7

About [2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate

[2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate (PubChem CID 123576735) has the molecular formula C10H22O4Si2 and a molecular weight of 262.45 g/mol. Its IUPAC name is [2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate.

Molecular Properties

Compound Name[2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate
PubChem CID123576735
Molecular FormulaC10H22O4Si2
Molecular Weight262.45 g/mol
Exact Mass262.11
IUPAC Name[2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC(C[SiH2]CO)O[Si](C)(C)C
InChIInChI=1S/C10H22O4Si2/c1-8(2)10(12)13-9(6-15-7-11)14-16(3,4)5/h9,11H,1,6-7,15H2,2-5H3
InChIKeyWDNDUWFWLGVOSP-UHFFFAOYSA-N
XLogP0.82
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.45
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate?
The IUPAC name of [2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate (CID 123576735) is [2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate.
What is the SMILES notation for [2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate?
The canonical SMILES for [2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate is C=C(C)C(=O)OC(C[SiH2]CO)O[Si](C)(C)C.
What is the InChIKey of [2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate?
The InChIKey is WDNDUWFWLGVOSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O4Si2/c1-8(2)10(12)13-9(6-15-7-11)14-16(3,4)5/h9,11H,1,6-7,15H2,2-5H3.
What are the key properties of [2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate?
[2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate has a molecular weight of 262.45 g/mol, XLogP of 0.82, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(hydroxymethylsilyl)-1-trimethylsilyloxyethyl] 2-methylprop-2-enoate is sourced from PubChem (CID 123576735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).