2-bromo-N-hydroxybenzamide

C7H6BrNO2 — CID 24701375

IUPAC2-bromo-N-hydroxybenzamide
SMILESO=C(NO)c1ccccc1Br
InChIInChI=1S/C7H6BrNO2/c8-6-4-2-1-3-5(6)7(10)9-11/h1-4,11H,(H,9,10)
InChIKeyAZPGONYSPBZNAZ-UHFFFAOYSA-N
MW216.03 g/mol
LogP1.57
Rot. Bonds1

About 2-bromo-N-hydroxybenzamide

2-bromo-N-hydroxybenzamide (PubChem CID 24701375) has the molecular formula C7H6BrNO2 and a molecular weight of 216.03 g/mol. Its IUPAC name is 2-bromo-N-hydroxybenzamide.

Molecular Properties

Compound Name2-bromo-N-hydroxybenzamide
PubChem CID24701375
Molecular FormulaC7H6BrNO2
Molecular Weight216.03 g/mol
Exact Mass214.96
IUPAC Name2-bromo-N-hydroxybenzamide
SMILESO=C(NO)c1ccccc1Br
InChIInChI=1S/C7H6BrNO2/c8-6-4-2-1-3-5(6)7(10)9-11/h1-4,11H,(H,9,10)
InChIKeyAZPGONYSPBZNAZ-UHFFFAOYSA-N
XLogP1.57
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.03
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', '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-N-hydroxybenzamide?
The IUPAC name of 2-bromo-N-hydroxybenzamide (CID 24701375) is 2-bromo-N-hydroxybenzamide.
What is the SMILES notation for 2-bromo-N-hydroxybenzamide?
The canonical SMILES for 2-bromo-N-hydroxybenzamide is O=C(NO)c1ccccc1Br.
What is the InChIKey of 2-bromo-N-hydroxybenzamide?
The InChIKey is AZPGONYSPBZNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrNO2/c8-6-4-2-1-3-5(6)7(10)9-11/h1-4,11H,(H,9,10).
What are the key properties of 2-bromo-N-hydroxybenzamide?
2-bromo-N-hydroxybenzamide has a molecular weight of 216.03 g/mol, XLogP of 1.57, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-hydroxybenzamide is sourced from PubChem (CID 24701375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).