3-(Methoxysilyl)propyl 2-methylprop-2-enoate

C8H14O3Si — CID 22222807

IUPAC—
SMILESC=C(C)C(=O)OCCC[Si]OC
InChIInChI=1S/C8H14O3Si/c1-7(2)8(9)11-5-4-6-12-10-3/h1,4-6H2,2-3H3
InChIKeyFZWORCNJMBFZCE-UHFFFAOYSA-N
MW186.28 g/mol
LogP1.18
Rot. Bonds6

About 3-(Methoxysilyl)propyl 2-methylprop-2-enoate

3-(Methoxysilyl)propyl 2-methylprop-2-enoate (PubChem CID 22222807) has the molecular formula C8H14O3Si and a molecular weight of 186.28 g/mol.

Molecular Properties

Compound Name3-(Methoxysilyl)propyl 2-methylprop-2-enoate
PubChem CID22222807
Molecular FormulaC8H14O3Si
Molecular Weight186.28 g/mol
Exact Mass186.07
IUPAC Name—
SMILESC=C(C)C(=O)OCCC[Si]OC
InChIInChI=1S/C8H14O3Si/c1-7(2)8(9)11-5-4-6-12-10-3/h1,4-6H2,2-3H3
InChIKeyFZWORCNJMBFZCE-UHFFFAOYSA-N
XLogP1.18
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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'}

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Frequently Asked Questions

What is the IUPAC name of 3-(Methoxysilyl)propyl 2-methylprop-2-enoate?
The IUPAC name of 3-(Methoxysilyl)propyl 2-methylprop-2-enoate (CID 22222807) is not available.
What is the SMILES notation for 3-(Methoxysilyl)propyl 2-methylprop-2-enoate?
The canonical SMILES for 3-(Methoxysilyl)propyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCC[Si]OC.
What is the InChIKey of 3-(Methoxysilyl)propyl 2-methylprop-2-enoate?
The InChIKey is FZWORCNJMBFZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O3Si/c1-7(2)8(9)11-5-4-6-12-10-3/h1,4-6H2,2-3H3.
What are the key properties of 3-(Methoxysilyl)propyl 2-methylprop-2-enoate?
3-(Methoxysilyl)propyl 2-methylprop-2-enoate has a molecular weight of 186.28 g/mol, XLogP of 1.18, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(Methoxysilyl)propyl 2-methylprop-2-enoate is sourced from PubChem (CID 22222807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).