nitroxyl;hydrobromide

H2BrNO — CID 141037657

IUPACnitroxyl;hydrobromide
SMILESBr.N=O
InChIInChI=1S/BrH.HNO/c;1-2/h1H;1H
InChIKeyDOYWHEQOQJRJOU-UHFFFAOYSA-N
MW111.93 g/mol
LogP0.91
Rot. Bonds

About nitroxyl;hydrobromide

nitroxyl;hydrobromide (PubChem CID 141037657) has the molecular formula H2BrNO and a molecular weight of 111.93 g/mol. Its IUPAC name is nitroxyl;hydrobromide.

Molecular Properties

Compound Namenitroxyl;hydrobromide
PubChem CID141037657
Molecular FormulaH2BrNO
Molecular Weight111.93 g/mol
Exact Mass110.93
IUPAC Namenitroxyl;hydrobromide
SMILESBr.N=O
InChIInChI=1S/BrH.HNO/c;1-2/h1H;1H
InChIKeyDOYWHEQOQJRJOU-UHFFFAOYSA-N
XLogP0.91
TPSA40.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.93
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of nitroxyl;hydrobromide?
The IUPAC name of nitroxyl;hydrobromide (CID 141037657) is nitroxyl;hydrobromide.
What is the SMILES notation for nitroxyl;hydrobromide?
The canonical SMILES for nitroxyl;hydrobromide is Br.N=O.
What is the InChIKey of nitroxyl;hydrobromide?
The InChIKey is DOYWHEQOQJRJOU-UHFFFAOYSA-N. The full InChI is InChI=1S/BrH.HNO/c;1-2/h1H;1H.
What are the key properties of nitroxyl;hydrobromide?
nitroxyl;hydrobromide has a molecular weight of 111.93 g/mol, XLogP of 0.91, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for nitroxyl;hydrobromide is sourced from PubChem (CID 141037657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).