CID 87719867

CBiIO — CID 87719867

IUPAC
SMILESO=C(I)[Bi]
InChIInChI=1S/CIO.Bi/c2-1-3;
InChIKeyGWVHQICGPBBRMB-UHFFFAOYSA-N
MW363.89 g/mol
LogP0.71
Rot. Bonds

About CID 87719867

CID 87719867 (PubChem CID 87719867) has the molecular formula CBiIO and a molecular weight of 363.89 g/mol.

Molecular Properties

Compound NameCID 87719867
PubChem CID87719867
Molecular FormulaCBiIO
Molecular Weight363.89 g/mol
Exact Mass363.88
IUPAC Name
SMILESO=C(I)[Bi]
InChIInChI=1S/CIO.Bi/c2-1-3;
InChIKeyGWVHQICGPBBRMB-UHFFFAOYSA-N
XLogP0.71
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.89
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 87719867?
The IUPAC name of CID 87719867 (CID 87719867) is not available.
What is the SMILES notation for CID 87719867?
The canonical SMILES for CID 87719867 is O=C(I)[Bi].
What is the InChIKey of CID 87719867?
The InChIKey is GWVHQICGPBBRMB-UHFFFAOYSA-N. The full InChI is InChI=1S/CIO.Bi/c2-1-3;.
What are the key properties of CID 87719867?
CID 87719867 has a molecular weight of 363.89 g/mol, XLogP of 0.71, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87719867 is sourced from PubChem (CID 87719867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).