2-bromo-5-hydrazinylphenol

C6H7BrN2O — CID 130767955

IUPAC2-bromo-5-hydrazinylphenol
SMILESNNc1ccc(Br)c(O)c1
InChIInChI=1S/C6H7BrN2O/c7-5-2-1-4(9-8)3-6(5)10/h1-3,9-10H,8H2
InChIKeyOTZNKDYPHWCYNC-UHFFFAOYSA-N
MW203.04 g/mol
LogP1.44
Rot. Bonds1

About 2-bromo-5-hydrazinylphenol

2-bromo-5-hydrazinylphenol (PubChem CID 130767955) has the molecular formula C6H7BrN2O and a molecular weight of 203.04 g/mol. Its IUPAC name is 2-bromo-5-hydrazinylphenol.

Molecular Properties

Compound Name2-bromo-5-hydrazinylphenol
PubChem CID130767955
Molecular FormulaC6H7BrN2O
Molecular Weight203.04 g/mol
Exact Mass201.97
IUPAC Name2-bromo-5-hydrazinylphenol
SMILESNNc1ccc(Br)c(O)c1
InChIInChI=1S/C6H7BrN2O/c7-5-2-1-4(9-8)3-6(5)10/h1-3,9-10H,8H2
InChIKeyOTZNKDYPHWCYNC-UHFFFAOYSA-N
XLogP1.44
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.04
LogP ≤ 51.44
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-bromo-5-hydrazinylphenol?
The IUPAC name of 2-bromo-5-hydrazinylphenol (CID 130767955) is 2-bromo-5-hydrazinylphenol.
What is the SMILES notation for 2-bromo-5-hydrazinylphenol?
The canonical SMILES for 2-bromo-5-hydrazinylphenol is NNc1ccc(Br)c(O)c1.
What is the InChIKey of 2-bromo-5-hydrazinylphenol?
The InChIKey is OTZNKDYPHWCYNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7BrN2O/c7-5-2-1-4(9-8)3-6(5)10/h1-3,9-10H,8H2.
What are the key properties of 2-bromo-5-hydrazinylphenol?
2-bromo-5-hydrazinylphenol has a molecular weight of 203.04 g/mol, XLogP of 1.44, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-hydrazinylphenol is sourced from PubChem (CID 130767955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).