CID 151076030

C3H3BiO — CID 151076030

IUPAC—
SMILESC=CC(=O)[Bi]
InChIInChI=1S/C3H3O.Bi/c1-2-3-4;/h2H,1H2;
InChIKeyMJDADDIGMNICCL-UHFFFAOYSA-N
MW264.04 g/mol
LogP-0.13
Rot. Bonds1

About CID 151076030

CID 151076030 (PubChem CID 151076030) has the molecular formula C3H3BiO and a molecular weight of 264.04 g/mol.

Molecular Properties

Compound NameCID 151076030
PubChem CID151076030
Molecular FormulaC3H3BiO
Molecular Weight264.04 g/mol
Exact Mass264.00
IUPAC Name—
SMILESC=CC(=O)[Bi]
InChIInChI=1S/C3H3O.Bi/c1-2-3-4;/h2H,1H2;
InChIKeyMJDADDIGMNICCL-UHFFFAOYSA-N
XLogP-0.13
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.04
LogP ≤ 5-0.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 151076030?
The IUPAC name of CID 151076030 (CID 151076030) is not available.
What is the SMILES notation for CID 151076030?
The canonical SMILES for CID 151076030 is C=CC(=O)[Bi].
What is the InChIKey of CID 151076030?
The InChIKey is MJDADDIGMNICCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3O.Bi/c1-2-3-4;/h2H,1H2;.
What are the key properties of CID 151076030?
CID 151076030 has a molecular weight of 264.04 g/mol, XLogP of -0.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 151076030 is sourced from PubChem (CID 151076030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).