ethyl 2-methyl-3-silylprop-2-enoate

C6H12O2Si — CID 173118701

IUPACethyl 2-methyl-3-silylprop-2-enoate
SMILESCCOC(=O)C(C)=C[SiH3]
InChIInChI=1S/C6H12O2Si/c1-3-8-6(7)5(2)4-9/h4H,3H2,1-2,9H3
InChIKeyKEIBATILFANZFN-UHFFFAOYSA-N
MW144.25 g/mol
LogP-0.18
Rot. Bonds2

About ethyl 2-methyl-3-silylprop-2-enoate

ethyl 2-methyl-3-silylprop-2-enoate (PubChem CID 173118701) has the molecular formula C6H12O2Si and a molecular weight of 144.25 g/mol. Its IUPAC name is ethyl 2-methyl-3-silylprop-2-enoate.

Molecular Properties

Compound Nameethyl 2-methyl-3-silylprop-2-enoate
PubChem CID173118701
Molecular FormulaC6H12O2Si
Molecular Weight144.25 g/mol
Exact Mass144.06
IUPAC Nameethyl 2-methyl-3-silylprop-2-enoate
SMILESCCOC(=O)C(C)=C[SiH3]
InChIInChI=1S/C6H12O2Si/c1-3-8-6(7)5(2)4-9/h4H,3H2,1-2,9H3
InChIKeyKEIBATILFANZFN-UHFFFAOYSA-N
XLogP-0.18
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.25
LogP ≤ 5-0.18
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

ethyl 3-amino-2-methylprop-2-enoate
CID 54558291
ethyl (E)-2-methylpent-2-enoate
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ethyl 3-(dimethylamino)-2-methylprop-2-enoate
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ethyl (E)-4-bromo-2-methylbut-2-enoate;methane
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diethyl 2-methylpent-2-enedioate
CID 592902
azane;ethyl 2,4,4-trimethylpent-2-enoate
CID 175378002
ethyl 2-methyl-3-sulfamoylprop-2-enoate
CID 175004605
ethyl 2-methyl-3-methylidenephosphanylprop-2-enoate
CID 91329650
ethyl 2-oxo(213C)propanoate
CID 71309469
CID 159370772
CID 159370772
ethyl (E)-2,4-dimethylhex-2-enoate
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Frequently Asked Questions

What is the IUPAC name of ethyl 2-methyl-3-silylprop-2-enoate?
The IUPAC name of ethyl 2-methyl-3-silylprop-2-enoate (CID 173118701) is ethyl 2-methyl-3-silylprop-2-enoate.
What is the SMILES notation for ethyl 2-methyl-3-silylprop-2-enoate?
The canonical SMILES for ethyl 2-methyl-3-silylprop-2-enoate is CCOC(=O)C(C)=C[SiH3].
What is the InChIKey of ethyl 2-methyl-3-silylprop-2-enoate?
The InChIKey is KEIBATILFANZFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O2Si/c1-3-8-6(7)5(2)4-9/h4H,3H2,1-2,9H3.
What are the key properties of ethyl 2-methyl-3-silylprop-2-enoate?
ethyl 2-methyl-3-silylprop-2-enoate has a molecular weight of 144.25 g/mol, XLogP of -0.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-methyl-3-silylprop-2-enoate is sourced from PubChem (CID 173118701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).