dibromo(phenyl)arsane

C6H5AsBr2 — CID 12761

IUPACdibromo(phenyl)arsane
SMILESBr[As](Br)c1ccccc1
InChIInChI=1S/C6H5AsBr2/c8-7(9)6-4-2-1-3-5-6/h1-5H
InChIKeyVLKNCAOBWGXFMR-UHFFFAOYSA-N
MW311.84 g/mol
LogP2.17
Rot. Bonds1

About dibromo(phenyl)arsane

dibromo(phenyl)arsane (PubChem CID 12761) has the molecular formula C6H5AsBr2 and a molecular weight of 311.84 g/mol. Its IUPAC name is dibromo(phenyl)arsane.

Molecular Properties

Compound Namedibromo(phenyl)arsane
PubChem CID12761
Molecular FormulaC6H5AsBr2
Molecular Weight311.84 g/mol
Exact Mass309.80
IUPAC Namedibromo(phenyl)arsane
SMILESBr[As](Br)c1ccccc1
InChIInChI=1S/C6H5AsBr2/c8-7(9)6-4-2-1-3-5-6/h1-5H
InChIKeyVLKNCAOBWGXFMR-UHFFFAOYSA-N
XLogP2.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.84
LogP ≤ 52.17
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 dibromo(phenyl)arsane?
The IUPAC name of dibromo(phenyl)arsane (CID 12761) is dibromo(phenyl)arsane.
What is the SMILES notation for dibromo(phenyl)arsane?
The canonical SMILES for dibromo(phenyl)arsane is Br[As](Br)c1ccccc1.
What is the InChIKey of dibromo(phenyl)arsane?
The InChIKey is VLKNCAOBWGXFMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5AsBr2/c8-7(9)6-4-2-1-3-5-6/h1-5H.
What are the key properties of dibromo(phenyl)arsane?
dibromo(phenyl)arsane has a molecular weight of 311.84 g/mol, XLogP of 2.17, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dibromo(phenyl)arsane is sourced from PubChem (CID 12761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).