(4-bromophenyl) selenohypobromite

C6H4Br2Se — CID 11834013

IUPAC(4-bromophenyl) selenohypobromite
SMILESBr[Se]c1ccc(Br)cc1
InChIInChI=1S/C6H4Br2Se/c7-5-1-3-6(9-8)4-2-5/h1-4H
InChIKeyPTNDXAVDVBHCIM-UHFFFAOYSA-N
MW314.87 g/mol
LogP2.09
Rot. Bonds1

About (4-bromophenyl) selenohypobromite

(4-bromophenyl) selenohypobromite (PubChem CID 11834013) has the molecular formula C6H4Br2Se and a molecular weight of 314.87 g/mol. Its IUPAC name is (4-bromophenyl) selenohypobromite.

Molecular Properties

Compound Name(4-bromophenyl) selenohypobromite
PubChem CID11834013
Molecular FormulaC6H4Br2Se
Molecular Weight314.87 g/mol
Exact Mass313.78
IUPAC Name(4-bromophenyl) selenohypobromite
SMILESBr[Se]c1ccc(Br)cc1
InChIInChI=1S/C6H4Br2Se/c7-5-1-3-6(9-8)4-2-5/h1-4H
InChIKeyPTNDXAVDVBHCIM-UHFFFAOYSA-N
XLogP2.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.87
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

azane;1,4-dibromobenzene
CID 175259215
1-bromo-4-[4-[4-(4-bromophenyl)phenyl]phenyl]benzene
CID 59775505
1,4-dibromobenzene;oxostibane
CID 173366156
tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide
CID 173034951
4-bromobenzeneselenolate
CID 13099932
4-[(4-bromophenyl)methylselanyl]aniline
CID 162787602
1-bromo-4-(131I)iodobenzene
CID 134858255
1-bromo-4-chlorobenzene
CID 7806
CID 20625474
CID 20625474
1-N,1-N,3-N,3-N,5-N,5-N-hexakis(4-bromophenyl)benzene-1,3,5-triamine
CID 134943535
1-(4-bromophenyl)selanyl-2,4-dimethylbenzene
CID 135044964
1-bromo-4-(4-bromophenoxy)benzene
CID 16305

Frequently Asked Questions

What is the IUPAC name of (4-bromophenyl) selenohypobromite?
The IUPAC name of (4-bromophenyl) selenohypobromite (CID 11834013) is (4-bromophenyl) selenohypobromite.
What is the SMILES notation for (4-bromophenyl) selenohypobromite?
The canonical SMILES for (4-bromophenyl) selenohypobromite is Br[Se]c1ccc(Br)cc1.
What is the InChIKey of (4-bromophenyl) selenohypobromite?
The InChIKey is PTNDXAVDVBHCIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Br2Se/c7-5-1-3-6(9-8)4-2-5/h1-4H.
What are the key properties of (4-bromophenyl) selenohypobromite?
(4-bromophenyl) selenohypobromite has a molecular weight of 314.87 g/mol, XLogP of 2.09, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenyl) selenohypobromite is sourced from PubChem (CID 11834013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).