bromo(phenyl)mercury

C6H5BrHg — CID 14509

IUPACbromo(phenyl)mercury
SMILESBr[Hg]c1ccccc1
InChIInChI=1S/C6H5.BrH.Hg/c1-2-4-6-5-3-1;;/h1-5H;1H;/q;;+1/p-1
InChIKeyPUPHNPSAIJQNEE-UHFFFAOYSA-M
MW357.60 g/mol
LogP1.70
Rot. Bonds1

About bromo(phenyl)mercury

bromo(phenyl)mercury (PubChem CID 14509) has the molecular formula C6H5BrHg and a molecular weight of 357.60 g/mol. Its IUPAC name is bromo(phenyl)mercury.

Molecular Properties

Compound Namebromo(phenyl)mercury
PubChem CID14509
Molecular FormulaC6H5BrHg
Molecular Weight357.60 g/mol
Exact Mass357.93
IUPAC Namebromo(phenyl)mercury
SMILESBr[Hg]c1ccccc1
InChIInChI=1S/C6H5.BrH.Hg/c1-2-4-6-5-3-1;;/h1-5H;1H;/q;;+1/p-1
InChIKeyPUPHNPSAIJQNEE-UHFFFAOYSA-M
XLogP1.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.60
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bromo(phenyl)mercury?
The IUPAC name of bromo(phenyl)mercury (CID 14509) is bromo(phenyl)mercury.
What is the SMILES notation for bromo(phenyl)mercury?
The canonical SMILES for bromo(phenyl)mercury is Br[Hg]c1ccccc1.
What is the InChIKey of bromo(phenyl)mercury?
The InChIKey is PUPHNPSAIJQNEE-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H5.BrH.Hg/c1-2-4-6-5-3-1;;/h1-5H;1H;/q;;+1/p-1.
What are the key properties of bromo(phenyl)mercury?
bromo(phenyl)mercury has a molecular weight of 357.60 g/mol, XLogP of 1.70, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromo(phenyl)mercury is sourced from PubChem (CID 14509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).