bromobenzene;hydroiodide

C6H6BrI — CID 161399395

IUPACbromobenzene;hydroiodide
SMILESBrc1ccccc1.I
InChIInChI=1S/C6H5Br.HI/c7-6-4-2-1-3-5-6;/h1-5H;1H
InChIKeyGGKKCRAATKPHPN-UHFFFAOYSA-N
MW284.92 g/mol
LogP3.07
Rot. Bonds

About bromobenzene;hydroiodide

bromobenzene;hydroiodide (PubChem CID 161399395) has the molecular formula C6H6BrI and a molecular weight of 284.92 g/mol. Its IUPAC name is bromobenzene;hydroiodide.

Molecular Properties

Compound Namebromobenzene;hydroiodide
PubChem CID161399395
Molecular FormulaC6H6BrI
Molecular Weight284.92 g/mol
Exact Mass283.87
IUPAC Namebromobenzene;hydroiodide
SMILESBrc1ccccc1.I
InChIInChI=1S/C6H5Br.HI/c7-6-4-2-1-3-5-6;/h1-5H;1H
InChIKeyGGKKCRAATKPHPN-UHFFFAOYSA-N
XLogP3.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.92
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bromobenzene;hydroiodide?
The IUPAC name of bromobenzene;hydroiodide (CID 161399395) is bromobenzene;hydroiodide.
What is the SMILES notation for bromobenzene;hydroiodide?
The canonical SMILES for bromobenzene;hydroiodide is Brc1ccccc1.I.
What is the InChIKey of bromobenzene;hydroiodide?
The InChIKey is GGKKCRAATKPHPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Br.HI/c7-6-4-2-1-3-5-6;/h1-5H;1H.
What are the key properties of bromobenzene;hydroiodide?
bromobenzene;hydroiodide has a molecular weight of 284.92 g/mol, XLogP of 3.07, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromobenzene;hydroiodide is sourced from PubChem (CID 161399395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).