O-phenylhydroxylamine;zirconium

C6H7NOZr — CID 174144426

IUPACO-phenylhydroxylamine;zirconium
SMILESNOc1ccccc1.[Zr]
InChIInChI=1S/C6H7NO.Zr/c7-8-6-4-2-1-3-5-6;/h1-5H,7H2;
InChIKeyFCLMZIFYGUGSSA-UHFFFAOYSA-N
MW200.35 g/mol
LogP0.94
Rot. Bonds1

About O-phenylhydroxylamine;zirconium

O-phenylhydroxylamine;zirconium (PubChem CID 174144426) has the molecular formula C6H7NOZr and a molecular weight of 200.35 g/mol. Its IUPAC name is O-phenylhydroxylamine;zirconium.

Molecular Properties

Compound NameO-phenylhydroxylamine;zirconium
PubChem CID174144426
Molecular FormulaC6H7NOZr
Molecular Weight200.35 g/mol
Exact Mass198.96
IUPAC NameO-phenylhydroxylamine;zirconium
SMILESNOc1ccccc1.[Zr]
InChIInChI=1S/C6H7NO.Zr/c7-8-6-4-2-1-3-5-6;/h1-5H,7H2;
InChIKeyFCLMZIFYGUGSSA-UHFFFAOYSA-N
XLogP0.94
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.35
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of O-phenylhydroxylamine;zirconium?
The IUPAC name of O-phenylhydroxylamine;zirconium (CID 174144426) is O-phenylhydroxylamine;zirconium.
What is the SMILES notation for O-phenylhydroxylamine;zirconium?
The canonical SMILES for O-phenylhydroxylamine;zirconium is NOc1ccccc1.[Zr].
What is the InChIKey of O-phenylhydroxylamine;zirconium?
The InChIKey is FCLMZIFYGUGSSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO.Zr/c7-8-6-4-2-1-3-5-6;/h1-5H,7H2;.
What are the key properties of O-phenylhydroxylamine;zirconium?
O-phenylhydroxylamine;zirconium has a molecular weight of 200.35 g/mol, XLogP of 0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-phenylhydroxylamine;zirconium is sourced from PubChem (CID 174144426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).