1,4-dibromobenzene;oxostibane

C6H5Br2OSb — CID 173366156

IUPAC1,4-dibromobenzene;oxostibane
SMILESBrc1ccc(Br)cc1.O=[SbH]
InChIInChI=1S/C6H4Br2.O.Sb.H/c7-5-1-2-6(8)4-3-5;;;/h1-4H;;;
InChIKeyFVTQGBJPYKIWFA-UHFFFAOYSA-N
MW374.67 g/mol
LogP2.44
Rot. Bonds

About 1,4-dibromobenzene;oxostibane

1,4-dibromobenzene;oxostibane (PubChem CID 173366156) has the molecular formula C6H5Br2OSb and a molecular weight of 374.67 g/mol. Its IUPAC name is 1,4-dibromobenzene;oxostibane.

Molecular Properties

Compound Name1,4-dibromobenzene;oxostibane
PubChem CID173366156
Molecular FormulaC6H5Br2OSb
Molecular Weight374.67 g/mol
Exact Mass371.77
IUPAC Name1,4-dibromobenzene;oxostibane
SMILESBrc1ccc(Br)cc1.O=[SbH]
InChIInChI=1S/C6H4Br2.O.Sb.H/c7-5-1-2-6(8)4-3-5;;;/h1-4H;;;
InChIKeyFVTQGBJPYKIWFA-UHFFFAOYSA-N
XLogP2.44
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.67
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1,4-dibromobenzene;oxostibane?
The IUPAC name of 1,4-dibromobenzene;oxostibane (CID 173366156) is 1,4-dibromobenzene;oxostibane.
What is the SMILES notation for 1,4-dibromobenzene;oxostibane?
The canonical SMILES for 1,4-dibromobenzene;oxostibane is Brc1ccc(Br)cc1.O=[SbH].
What is the InChIKey of 1,4-dibromobenzene;oxostibane?
The InChIKey is FVTQGBJPYKIWFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Br2.O.Sb.H/c7-5-1-2-6(8)4-3-5;;;/h1-4H;;;.
What are the key properties of 1,4-dibromobenzene;oxostibane?
1,4-dibromobenzene;oxostibane has a molecular weight of 374.67 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dibromobenzene;oxostibane is sourced from PubChem (CID 173366156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).