CID 158865603

Br3I3 — CID 158865603

IUPAC—
SMILESBrI.BrI.BrI
InChIInChI=1S/3BrI/c3*1-2
InChIKeyJBEOZKFNAKOGJG-UHFFFAOYSA-N
MW620.42 g/mol
LogP5.19
Rot. Bonds

About CID 158865603

CID 158865603 (PubChem CID 158865603) has the molecular formula Br3I3 and a molecular weight of 620.42 g/mol.

Molecular Properties

Compound NameCID 158865603
PubChem CID158865603
Molecular FormulaBr3I3
Molecular Weight620.42 g/mol
Exact Mass617.47
IUPAC Name—
SMILESBrI.BrI.BrI
InChIInChI=1S/3BrI/c3*1-2
InChIKeyJBEOZKFNAKOGJG-UHFFFAOYSA-N
XLogP5.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500620.42
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

CID 131738952
CID 131738952
CID 19911251
CID 19911251

Frequently Asked Questions

What is the IUPAC name of CID 158865603?
The IUPAC name of CID 158865603 (CID 158865603) is not available.
What is the SMILES notation for CID 158865603?
The canonical SMILES for CID 158865603 is BrI.BrI.BrI.
What is the InChIKey of CID 158865603?
The InChIKey is JBEOZKFNAKOGJG-UHFFFAOYSA-N. The full InChI is InChI=1S/3BrI/c3*1-2.
What are the key properties of CID 158865603?
CID 158865603 has a molecular weight of 620.42 g/mol, XLogP of 5.19, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158865603 is sourced from PubChem (CID 158865603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).