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

C10H20O3Si — CID 3017711

IUPAC3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](C)(C)OC
InChIInChI=1S/C10H20O3Si/c1-9(2)10(11)13-7-6-8-14(4,5)12-3/h1,6-8H2,2-5H3
InChIKeyJBDMKOVTOUIKFI-UHFFFAOYSA-N
MW216.35 g/mol
LogP2.35
Rot. Bonds6

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

3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate (PubChem CID 3017711) has the molecular formula C10H20O3Si and a molecular weight of 216.35 g/mol. Its IUPAC name is 3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
PubChem CID3017711
Molecular FormulaC10H20O3Si
Molecular Weight216.35 g/mol
Exact Mass216.12
IUPAC Name3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](C)(C)OC
InChIInChI=1S/C10H20O3Si/c1-9(2)10(11)13-7-6-8-14(4,5)12-3/h1,6-8H2,2-5H3
InChIKeyJBDMKOVTOUIKFI-UHFFFAOYSA-N
XLogP2.35
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 52.35
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-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate?
The IUPAC name of 3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate (CID 3017711) is 3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate.
What is the SMILES notation for 3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate?
The canonical SMILES for 3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCC[Si](C)(C)OC.
What is the InChIKey of 3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate?
The InChIKey is JBDMKOVTOUIKFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3Si/c1-9(2)10(11)13-7-6-8-14(4,5)12-3/h1,6-8H2,2-5H3.
What are the key properties of 3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate?
3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate has a molecular weight of 216.35 g/mol, XLogP of 2.35, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate is sourced from PubChem (CID 3017711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).