CID 58635188

C8H4BiNO2 — CID 58635188

IUPAC—
SMILESO=C1c2ccccc2C(=O)N1[Bi]
InChIInChI=1S/C8H5NO2.Bi/c10-7-5-3-1-2-4-6(5)8(11)9-7;/h1-4H,(H,9,10,11);/q;+1/p-1
InChIKeyUXHNWEAWVMVCNG-UHFFFAOYSA-M
MW355.11 g/mol
LogP0.37
Rot. Bonds

About CID 58635188

CID 58635188 (PubChem CID 58635188) has the molecular formula C8H4BiNO2 and a molecular weight of 355.11 g/mol.

Molecular Properties

Compound NameCID 58635188
PubChem CID58635188
Molecular FormulaC8H4BiNO2
Molecular Weight355.11 g/mol
Exact Mass355.00
IUPAC Name—
SMILESO=C1c2ccccc2C(=O)N1[Bi]
InChIInChI=1S/C8H5NO2.Bi/c10-7-5-3-1-2-4-6(5)8(11)9-7;/h1-4H,(H,9,10,11);/q;+1/p-1
InChIKeyUXHNWEAWVMVCNG-UHFFFAOYSA-M
XLogP0.37
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.11
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 58635188?
The IUPAC name of CID 58635188 (CID 58635188) is not available.
What is the SMILES notation for CID 58635188?
The canonical SMILES for CID 58635188 is O=C1c2ccccc2C(=O)N1[Bi].
What is the InChIKey of CID 58635188?
The InChIKey is UXHNWEAWVMVCNG-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H5NO2.Bi/c10-7-5-3-1-2-4-6(5)8(11)9-7;/h1-4H,(H,9,10,11);/q;+1/p-1.
What are the key properties of CID 58635188?
CID 58635188 has a molecular weight of 355.11 g/mol, XLogP of 0.37, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58635188 is sourced from PubChem (CID 58635188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).