ethenylsilyl 2-methylprop-2-enoate

C6H10O2Si — CID 150997629

IUPACethenylsilyl 2-methylprop-2-enoate
SMILESC=C[SiH2]OC(=O)C(=C)C
InChIInChI=1S/C6H10O2Si/c1-4-9-8-6(7)5(2)3/h4H,1-2,9H2,3H3
InChIKeyLTKYYZUBHOAMQQ-UHFFFAOYSA-N
MW142.23 g/mol
LogP0.33
Rot. Bonds3

About ethenylsilyl 2-methylprop-2-enoate

ethenylsilyl 2-methylprop-2-enoate (PubChem CID 150997629) has the molecular formula C6H10O2Si and a molecular weight of 142.23 g/mol. Its IUPAC name is ethenylsilyl 2-methylprop-2-enoate.

Molecular Properties

Compound Nameethenylsilyl 2-methylprop-2-enoate
PubChem CID150997629
Molecular FormulaC6H10O2Si
Molecular Weight142.23 g/mol
Exact Mass142.05
IUPAC Nameethenylsilyl 2-methylprop-2-enoate
SMILESC=C[SiH2]OC(=O)C(=C)C
InChIInChI=1S/C6H10O2Si/c1-4-9-8-6(7)5(2)3/h4H,1-2,9H2,3H3
InChIKeyLTKYYZUBHOAMQQ-UHFFFAOYSA-N
XLogP0.33
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.23
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 ethenylsilyl 2-methylprop-2-enoate?
The IUPAC name of ethenylsilyl 2-methylprop-2-enoate (CID 150997629) is ethenylsilyl 2-methylprop-2-enoate.
What is the SMILES notation for ethenylsilyl 2-methylprop-2-enoate?
The canonical SMILES for ethenylsilyl 2-methylprop-2-enoate is C=C[SiH2]OC(=O)C(=C)C.
What is the InChIKey of ethenylsilyl 2-methylprop-2-enoate?
The InChIKey is LTKYYZUBHOAMQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O2Si/c1-4-9-8-6(7)5(2)3/h4H,1-2,9H2,3H3.
What are the key properties of ethenylsilyl 2-methylprop-2-enoate?
ethenylsilyl 2-methylprop-2-enoate has a molecular weight of 142.23 g/mol, XLogP of 0.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenylsilyl 2-methylprop-2-enoate is sourced from PubChem (CID 150997629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).