2,4-dibromo-5-hydrazinylphenol

C6H6Br2N2O — CID 139823045

IUPAC2,4-dibromo-5-hydrazinylphenol
SMILESNNc1cc(O)c(Br)cc1Br
InChIInChI=1S/C6H6Br2N2O/c7-3-1-4(8)6(11)2-5(3)10-9/h1-2,10-11H,9H2
InChIKeyGYBSDTCGPMXCLU-UHFFFAOYSA-N
MW281.94 g/mol
LogP2.20
Rot. Bonds1

About 2,4-dibromo-5-hydrazinylphenol

2,4-dibromo-5-hydrazinylphenol (PubChem CID 139823045) has the molecular formula C6H6Br2N2O and a molecular weight of 281.94 g/mol. Its IUPAC name is 2,4-dibromo-5-hydrazinylphenol.

Molecular Properties

Compound Name2,4-dibromo-5-hydrazinylphenol
PubChem CID139823045
Molecular FormulaC6H6Br2N2O
Molecular Weight281.94 g/mol
Exact Mass279.88
IUPAC Name2,4-dibromo-5-hydrazinylphenol
SMILESNNc1cc(O)c(Br)cc1Br
InChIInChI=1S/C6H6Br2N2O/c7-3-1-4(8)6(11)2-5(3)10-9/h1-2,10-11H,9H2
InChIKeyGYBSDTCGPMXCLU-UHFFFAOYSA-N
XLogP2.20
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.94
LogP ≤ 52.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,4-dibromo-5-hydrazinylphenol?
The IUPAC name of 2,4-dibromo-5-hydrazinylphenol (CID 139823045) is 2,4-dibromo-5-hydrazinylphenol.
What is the SMILES notation for 2,4-dibromo-5-hydrazinylphenol?
The canonical SMILES for 2,4-dibromo-5-hydrazinylphenol is NNc1cc(O)c(Br)cc1Br.
What is the InChIKey of 2,4-dibromo-5-hydrazinylphenol?
The InChIKey is GYBSDTCGPMXCLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6Br2N2O/c7-3-1-4(8)6(11)2-5(3)10-9/h1-2,10-11H,9H2.
What are the key properties of 2,4-dibromo-5-hydrazinylphenol?
2,4-dibromo-5-hydrazinylphenol has a molecular weight of 281.94 g/mol, XLogP of 2.20, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dibromo-5-hydrazinylphenol is sourced from PubChem (CID 139823045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).