O-phenylhydroxylamine;zinc

C6H7NOZn — CID 175464016

IUPACO-phenylhydroxylamine;zinc
SMILESNOc1ccccc1.[Zn]
InChIInChI=1S/C6H7NO.Zn/c7-8-6-4-2-1-3-5-6;/h1-5H,7H2;
InChIKeyPDKXZCMUYDZMHP-UHFFFAOYSA-N
MW174.52 g/mol
LogP0.94
Rot. Bonds1

About O-phenylhydroxylamine;zinc

O-phenylhydroxylamine;zinc (PubChem CID 175464016) has the molecular formula C6H7NOZn and a molecular weight of 174.52 g/mol. Its IUPAC name is O-phenylhydroxylamine;zinc.

Molecular Properties

Compound NameO-phenylhydroxylamine;zinc
PubChem CID175464016
Molecular FormulaC6H7NOZn
Molecular Weight174.52 g/mol
Exact Mass172.98
IUPAC NameO-phenylhydroxylamine;zinc
SMILESNOc1ccccc1.[Zn]
InChIInChI=1S/C6H7NO.Zn/c7-8-6-4-2-1-3-5-6;/h1-5H,7H2;
InChIKeyPDKXZCMUYDZMHP-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 ≤ 500174.52
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of O-phenylhydroxylamine;zinc?
The IUPAC name of O-phenylhydroxylamine;zinc (CID 175464016) is O-phenylhydroxylamine;zinc.
What is the SMILES notation for O-phenylhydroxylamine;zinc?
The canonical SMILES for O-phenylhydroxylamine;zinc is NOc1ccccc1.[Zn].
What is the InChIKey of O-phenylhydroxylamine;zinc?
The InChIKey is PDKXZCMUYDZMHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO.Zn/c7-8-6-4-2-1-3-5-6;/h1-5H,7H2;.
What are the key properties of O-phenylhydroxylamine;zinc?
O-phenylhydroxylamine;zinc has a molecular weight of 174.52 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;zinc is sourced from PubChem (CID 175464016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).