[diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate

C12H20O4Pb — CID 16684328

IUPAC[diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O[Pb](CC)(CC)OC(=O)C(=C)C
InChIInChI=1S/2C4H6O2.2C2H5.Pb/c2*1-3(2)4(5)6;2*1-2;/h2*1H2,2H3,(H,5,6);2*1H2,2H3;/q;;;;+2/p-2
InChIKeyFOMAIMGROFMTIF-UHFFFAOYSA-L
MW435.49 g/mol
LogP2.71
Rot. Bonds6

About [diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate

[diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate (PubChem CID 16684328) has the molecular formula C12H20O4Pb and a molecular weight of 435.49 g/mol. Its IUPAC name is [diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate.

Molecular Properties

Compound Name[diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate
PubChem CID16684328
Molecular FormulaC12H20O4Pb
Molecular Weight435.49 g/mol
Exact Mass436.11
IUPAC Name[diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O[Pb](CC)(CC)OC(=O)C(=C)C
InChIInChI=1S/2C4H6O2.2C2H5.Pb/c2*1-3(2)4(5)6;2*1-2;/h2*1H2,2H3,(H,5,6);2*1H2,2H3;/q;;;;+2/p-2
InChIKeyFOMAIMGROFMTIF-UHFFFAOYSA-L
XLogP2.71
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.49
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

ethyl 2-methylprop-2-enoate
CID 130475774
2,2,2-trihydroxyethyl 2-methylprop-2-enoate
CID 87642108
sodium ethyl 2-methylprop-2-enoate
CID 23346885
ethane;bis(ethyl 2-methylprop-2-enoate)
CID 146295289
ethyl 2-methylprop-2-enoate;phosphane
CID 159151613
ethyl 2-methylprop-2-enoate;methane
CID 159235789
2-methylprop-1-ene;2-methylprop-2-enoyl 2-methylprop-2-enoate
CID 170331800
tris(hydroxymethyl 2-methylprop-2-enoate);propane
CID 157070076
sodium;ethyl 2-methylprop-2-enoate;hydride
CID 173442862
ethylcarbamoyl 2-methylprop-2-eneperoxoate
CID 87088549
azane;propyl 2-methylprop-2-enoate
CID 172812841
2-isocyanobutyl 2-methylprop-2-enoate
CID 141496484

Frequently Asked Questions

What is the IUPAC name of [diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate?
The IUPAC name of [diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate (CID 16684328) is [diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate.
What is the SMILES notation for [diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate?
The canonical SMILES for [diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate is C=C(C)C(=O)O[Pb](CC)(CC)OC(=O)C(=C)C.
What is the InChIKey of [diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate?
The InChIKey is FOMAIMGROFMTIF-UHFFFAOYSA-L. The full InChI is InChI=1S/2C4H6O2.2C2H5.Pb/c2*1-3(2)4(5)6;2*1-2;/h2*1H2,2H3,(H,5,6);2*1H2,2H3;/q;;;;+2/p-2.
What are the key properties of [diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate?
[diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate has a molecular weight of 435.49 g/mol, XLogP of 2.71, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [diethyl(2-methylprop-2-enoyloxy)plumbyl] 2-methylprop-2-enoate is sourced from PubChem (CID 16684328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).