[dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate

C11H22O2Si — CID 139703188

IUPAC[dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O[Si](C)(C)CCC(C)C
InChIInChI=1S/C11H22O2Si/c1-9(2)7-8-14(5,6)13-11(12)10(3)4/h9H,3,7-8H2,1-2,4-6H3
InChIKeyXITYWFNBYMYLIP-UHFFFAOYSA-N
MW214.38 g/mol
LogP3.36
Rot. Bonds5

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

[dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate (PubChem CID 139703188) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is [dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate.

Molecular Properties

Compound Name[dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate
PubChem CID139703188
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Name[dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O[Si](C)(C)CCC(C)C
InChIInChI=1S/C11H22O2Si/c1-9(2)7-8-14(5,6)13-11(12)10(3)4/h9H,3,7-8H2,1-2,4-6H3
InChIKeyXITYWFNBYMYLIP-UHFFFAOYSA-N
XLogP3.36
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 53.36
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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Related Compounds

ethane-1,2-diol;trimethylsilyl 2-methylprop-2-enoate
CID 87381259
2,17-dimethyloctadecan-9-yl 2-methylprop-2-enoate
CID 142686582
[10-methyl-1-(2-methylprop-2-enoyloxy)undecyl] 2-methylprop-2-enoate
CID 140695819
[methyl(dipropoxy)silyl] 2-methylprop-2-enoate
CID 151665203
[12-methyl-2-(8-methylnonyl)tridecyl] 2-methylprop-2-enoate
CID 140900809
propan-2-yl 2-methylprop-2-enoate
CID 146421311
[methoxy(dimethyl)silyl] 2-methylprop-2-enoate
CID 87401455
3-[dimethyl-[1-(2-methylprop-2-enoyloxy)ethoxy]silyl]propyl 2-methylprop-2-enoate
CID 158705227
[1-[diacetyloxy(methyl)silyl]-2,5-dimethylhexan-3-yl] 2-methylprop-2-enoate
CID 21465801
[(2R,3R)-3-(2-methylprop-2-enoyloxy)butan-2-yl] 2-methylprop-2-enoate
CID 91001649
[dibutyl(2-methylprop-2-enoyloxy)silyl] 2-methylprop-2-enoate
CID 153439669
tris(trimethylsilyloxy)silyl 2-methylprop-2-enoate
CID 23108290

Frequently Asked Questions

What is the IUPAC name of [dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate?
The IUPAC name of [dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate (CID 139703188) is [dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate.
What is the SMILES notation for [dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate?
The canonical SMILES for [dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate is C=C(C)C(=O)O[Si](C)(C)CCC(C)C.
What is the InChIKey of [dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate?
The InChIKey is XITYWFNBYMYLIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-9(2)7-8-14(5,6)13-11(12)10(3)4/h9H,3,7-8H2,1-2,4-6H3.
What are the key properties of [dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate?
[dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate has a molecular weight of 214.38 g/mol, XLogP of 3.36, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(3-methylbutyl)silyl] 2-methylprop-2-enoate is sourced from PubChem (CID 139703188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).