methylsilyl 2-methylprop-2-enoate

C5H10O2Si — CID 123839262

IUPACmethylsilyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O[SiH2]C
InChIInChI=1S/C5H10O2Si/c1-4(2)5(6)7-8-3/h1,8H2,2-3H3
InChIKeyKLAAZACFGBDLCX-UHFFFAOYSA-N
MW130.22 g/mol
LogP0.24
Rot. Bonds2

About methylsilyl 2-methylprop-2-enoate

methylsilyl 2-methylprop-2-enoate (PubChem CID 123839262) has the molecular formula C5H10O2Si and a molecular weight of 130.22 g/mol. Its IUPAC name is methylsilyl 2-methylprop-2-enoate.

Molecular Properties

Compound Namemethylsilyl 2-methylprop-2-enoate
PubChem CID123839262
Molecular FormulaC5H10O2Si
Molecular Weight130.22 g/mol
Exact Mass130.05
IUPAC Namemethylsilyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O[SiH2]C
InChIInChI=1S/C5H10O2Si/c1-4(2)5(6)7-8-3/h1,8H2,2-3H3
InChIKeyKLAAZACFGBDLCX-UHFFFAOYSA-N
XLogP0.24
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.22
LogP ≤ 50.24
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 methylsilyl 2-methylprop-2-enoate?
The IUPAC name of methylsilyl 2-methylprop-2-enoate (CID 123839262) is methylsilyl 2-methylprop-2-enoate.
What is the SMILES notation for methylsilyl 2-methylprop-2-enoate?
The canonical SMILES for methylsilyl 2-methylprop-2-enoate is C=C(C)C(=O)O[SiH2]C.
What is the InChIKey of methylsilyl 2-methylprop-2-enoate?
The InChIKey is KLAAZACFGBDLCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O2Si/c1-4(2)5(6)7-8-3/h1,8H2,2-3H3.
What are the key properties of methylsilyl 2-methylprop-2-enoate?
methylsilyl 2-methylprop-2-enoate has a molecular weight of 130.22 g/mol, XLogP of 0.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methylsilyl 2-methylprop-2-enoate is sourced from PubChem (CID 123839262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).