3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate

C11H22O4Si — CID 139816459

IUPAC3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCOCCC[Si](C)(C)OC
InChIInChI=1S/C11H22O4Si/c1-10(2)11(12)15-9-14-7-6-8-16(4,5)13-3/h1,6-9H2,2-5H3
InChIKeyFSNVBCZFOSIDOB-UHFFFAOYSA-N
MW246.38 g/mol
LogP2.32
Rot. Bonds8

About 3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate

3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate (PubChem CID 139816459) has the molecular formula C11H22O4Si and a molecular weight of 246.38 g/mol. Its IUPAC name is 3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate
PubChem CID139816459
Molecular FormulaC11H22O4Si
Molecular Weight246.38 g/mol
Exact Mass246.13
IUPAC Name3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCOCCC[Si](C)(C)OC
InChIInChI=1S/C11H22O4Si/c1-10(2)11(12)15-9-14-7-6-8-16(4,5)13-3/h1,6-9H2,2-5H3
InChIKeyFSNVBCZFOSIDOB-UHFFFAOYSA-N
XLogP2.32
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate?
The IUPAC name of 3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate (CID 139816459) is 3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate.
What is the SMILES notation for 3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate?
The canonical SMILES for 3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate is C=C(C)C(=O)OCOCCC[Si](C)(C)OC.
What is the InChIKey of 3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate?
The InChIKey is FSNVBCZFOSIDOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O4Si/c1-10(2)11(12)15-9-14-7-6-8-16(4,5)13-3/h1,6-9H2,2-5H3.
What are the key properties of 3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate?
3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate has a molecular weight of 246.38 g/mol, XLogP of 2.32, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methoxy(dimethyl)silyl]propoxymethyl 2-methylprop-2-enoate is sourced from PubChem (CID 139816459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).