3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate

C21H54O5Si7 — CID 87282260

IUPAC3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate
SMILESC=CC(=O)OCCC[Si](O[Si](C)(C)[Si](C)(C)C)(O[Si](C)(C)[Si](C)(C)C)O[Si](C)(C)[Si](C)(C)C
InChIInChI=1S/C21H54O5Si7/c1-17-21(22)23-19-18-20-33(24-30(11,12)27(2,3)4,25-31(13,14)28(5,6)7)26-32(15,16)29(8,9)10/h17H,1,18-20H2,2-16H3
InChIKeyXWBAQNSOQXKWPE-UHFFFAOYSA-N
MW583.26 g/mol
LogP6.96
Rot. Bonds14

About 3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate

3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate (PubChem CID 87282260) has the molecular formula C21H54O5Si7 and a molecular weight of 583.26 g/mol. Its IUPAC name is 3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate.

Molecular Properties

Compound Name3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate
PubChem CID87282260
Molecular FormulaC21H54O5Si7
Molecular Weight583.26 g/mol
Exact Mass582.24
IUPAC Name3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate
SMILESC=CC(=O)OCCC[Si](O[Si](C)(C)[Si](C)(C)C)(O[Si](C)(C)[Si](C)(C)C)O[Si](C)(C)[Si](C)(C)C
InChIInChI=1S/C21H54O5Si7/c1-17-21(22)23-19-18-20-33(24-30(11,12)27(2,3)4,25-31(13,14)28(5,6)7)26-32(15,16)29(8,9)10/h17H,1,18-20H2,2-16H3
InChIKeyXWBAQNSOQXKWPE-UHFFFAOYSA-N
XLogP6.96
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500583.26
LogP ≤ 56.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate with MolForge

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Related Compounds

3-[3-tris(trimethylsilyloxy)silylpropoxy]propyl prop-2-enoate
CID 59642122
3-[[dimethoxy(3-prop-2-enoyloxypropyl)silyl]oxy-dimethoxysilyl]propyl prop-2-enoate
CID 18468769
3-trimethoxysilylpropyl prop-2-enoate;hydrate
CID 141437630
3-[[bis[[dimethyl(3-prop-2-enoyloxypropyl)silyl]oxy]-propylsilyl]oxy-dimethylsilyl]propyl prop-2-enoate
CID 166010478
3-tris[[ethenyl(dimethoxy)silyl]oxy]silylpropyl prop-2-enoate
CID 142752557
3-tris[[dimethyl(3,3,3-trifluoropropyl)silyl]oxy]silylpropyl prop-2-enoate
CID 141294200
phosphoric acid;3-trimethoxysilylpropyl prop-2-enoate
CID 174981814
3-[tris(3-prop-2-enoyloxypropyl)silyl]propyl prop-2-enoate
CID 140784915
prop-2-enoic acid;3-triethoxysilylpropyl prop-2-enoate
CID 158718289
3-[dimethyl(trimethoxysilyloxy)silyl]propyl prop-2-enoate
CID 22726207
3-tripentoxysilylpropyl prop-2-enoate
CID 151204895
3-[tris(2-methylpropoxy)silyl]propyl prop-2-enoate
CID 139908438

Frequently Asked Questions

What is the IUPAC name of 3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate?
The IUPAC name of 3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate (CID 87282260) is 3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate.
What is the SMILES notation for 3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate?
The canonical SMILES for 3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate is C=CC(=O)OCCC[Si](O[Si](C)(C)[Si](C)(C)C)(O[Si](C)(C)[Si](C)(C)C)O[Si](C)(C)[Si](C)(C)C.
What is the InChIKey of 3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate?
The InChIKey is XWBAQNSOQXKWPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H54O5Si7/c1-17-21(22)23-19-18-20-33(24-30(11,12)27(2,3)4,25-31(13,14)28(5,6)7)26-32(15,16)29(8,9)10/h17H,1,18-20H2,2-16H3.
What are the key properties of 3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate?
3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate has a molecular weight of 583.26 g/mol, XLogP of 6.96, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tris[[dimethyl(trimethylsilyl)silyl]oxy]silylpropyl prop-2-enoate is sourced from PubChem (CID 87282260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).