benzeneselenol;hydrobromide

C6H7BrSe — CID 173030262

IUPACbenzeneselenol;hydrobromide
SMILESBr.[SeH]c1ccccc1
InChIInChI=1S/C6H6Se.BrH/c7-6-4-2-1-3-5-6;/h1-5,7H;1H
InChIKeyJWEYEZJLBIXALW-UHFFFAOYSA-N
MW237.99 g/mol
LogP0.79
Rot. Bonds

About benzeneselenol;hydrobromide

benzeneselenol;hydrobromide (PubChem CID 173030262) has the molecular formula C6H7BrSe and a molecular weight of 237.99 g/mol. Its IUPAC name is benzeneselenol;hydrobromide.

Molecular Properties

Compound Namebenzeneselenol;hydrobromide
PubChem CID173030262
Molecular FormulaC6H7BrSe
Molecular Weight237.99 g/mol
Exact Mass237.89
IUPAC Namebenzeneselenol;hydrobromide
SMILESBr.[SeH]c1ccccc1
InChIInChI=1S/C6H6Se.BrH/c7-6-4-2-1-3-5-6;/h1-5,7H;1H
InChIKeyJWEYEZJLBIXALW-UHFFFAOYSA-N
XLogP0.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.99
LogP ≤ 50.79
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 benzeneselenol;hydrobromide?
The IUPAC name of benzeneselenol;hydrobromide (CID 173030262) is benzeneselenol;hydrobromide.
What is the SMILES notation for benzeneselenol;hydrobromide?
The canonical SMILES for benzeneselenol;hydrobromide is Br.[SeH]c1ccccc1.
What is the InChIKey of benzeneselenol;hydrobromide?
The InChIKey is JWEYEZJLBIXALW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6Se.BrH/c7-6-4-2-1-3-5-6;/h1-5,7H;1H.
What are the key properties of benzeneselenol;hydrobromide?
benzeneselenol;hydrobromide has a molecular weight of 237.99 g/mol, XLogP of 0.79, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzeneselenol;hydrobromide is sourced from PubChem (CID 173030262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).