CID 6330352

C6H13O2Pb — CID 6330352

IUPAC—
SMILESC=CC(=O)O.C[Pb](C)C
InChIInChI=1S/C3H4O2.3CH3.Pb/c1-2-3(4)5;;;;/h2H,1H2,(H,4,5);3*1H3;
InChIKeyPAIIOLRGTBLCDX-UHFFFAOYSA-N
MW324.37 g/mol
LogP1.63
Rot. Bonds1

About CID 6330352

CID 6330352 (PubChem CID 6330352) has the molecular formula C6H13O2Pb and a molecular weight of 324.37 g/mol.

Molecular Properties

Compound NameCID 6330352
PubChem CID6330352
Molecular FormulaC6H13O2Pb
Molecular Weight324.37 g/mol
Exact Mass325.07
IUPAC Name—
SMILESC=CC(=O)O.C[Pb](C)C
InChIInChI=1S/C3H4O2.3CH3.Pb/c1-2-3(4)5;;;;/h2H,1H2,(H,4,5);3*1H3;
InChIKeyPAIIOLRGTBLCDX-UHFFFAOYSA-N
XLogP1.63
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.37
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 87061462
prop-2-enoic acid;hexahydrate
CID 172682107
azane;prop-2-enoic acid
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Frequently Asked Questions

What is the IUPAC name of CID 6330352?
The IUPAC name of CID 6330352 (CID 6330352) is not available.
What is the SMILES notation for CID 6330352?
The canonical SMILES for CID 6330352 is C=CC(=O)O.C[Pb](C)C.
What is the InChIKey of CID 6330352?
The InChIKey is PAIIOLRGTBLCDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4O2.3CH3.Pb/c1-2-3(4)5;;;;/h2H,1H2,(H,4,5);3*1H3;.
What are the key properties of CID 6330352?
CID 6330352 has a molecular weight of 324.37 g/mol, XLogP of 1.63, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 6330352 is sourced from PubChem (CID 6330352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).