CID 89223258

CBI2O — CID 89223258

IUPAC—
SMILESO=C(I)[B]I
InChIInChI=1S/CBI2O/c3-1(5)2-4
InChIKeyYOMYEKHFEIAJQH-UHFFFAOYSA-N
MW292.63 g/mol
LogP1.60
Rot. Bonds1

About CID 89223258

CID 89223258 (PubChem CID 89223258) has the molecular formula CBI2O and a molecular weight of 292.63 g/mol.

Molecular Properties

Compound NameCID 89223258
PubChem CID89223258
Molecular FormulaCBI2O
Molecular Weight292.63 g/mol
Exact Mass292.81
IUPAC Name—
SMILESO=C(I)[B]I
InChIInChI=1S/CBI2O/c3-1(5)2-4
InChIKeyYOMYEKHFEIAJQH-UHFFFAOYSA-N
XLogP1.60
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.63
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 89223258?
The IUPAC name of CID 89223258 (CID 89223258) is not available.
What is the SMILES notation for CID 89223258?
The canonical SMILES for CID 89223258 is O=C(I)[B]I.
What is the InChIKey of CID 89223258?
The InChIKey is YOMYEKHFEIAJQH-UHFFFAOYSA-N. The full InChI is InChI=1S/CBI2O/c3-1(5)2-4.
What are the key properties of CID 89223258?
CID 89223258 has a molecular weight of 292.63 g/mol, XLogP of 1.60, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 89223258 is sourced from PubChem (CID 89223258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).