N-phenylhydroxylamine

C6H7NO — CID 7518

IUPACN-phenylhydroxylamine
SMILESONc1ccccc1
InChIInChI=1S/C6H7NO/c8-7-6-4-2-1-3-5-6/h1-5,7-8H
InChIKeyCKRZKMFTZCFYGB-UHFFFAOYSA-N
MW109.13 g/mol
LogP1.49
Rot. Bonds1

About N-phenylhydroxylamine

N-phenylhydroxylamine (PubChem CID 7518) has the molecular formula C6H7NO and a molecular weight of 109.13 g/mol. Its IUPAC name is N-phenylhydroxylamine.

Molecular Properties

Compound NameN-phenylhydroxylamine
PubChem CID7518
Molecular FormulaC6H7NO
Molecular Weight109.13 g/mol
Exact Mass109.05
IUPAC NameN-phenylhydroxylamine
SMILESONc1ccccc1
InChIInChI=1S/C6H7NO/c8-7-6-4-2-1-3-5-6/h1-5,7-8H
InChIKeyCKRZKMFTZCFYGB-UHFFFAOYSA-N
XLogP1.49
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.13
LogP ≤ 51.49
H-Bond Donors ≤ 52
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 N-phenylhydroxylamine?
The IUPAC name of N-phenylhydroxylamine (CID 7518) is N-phenylhydroxylamine.
What is the SMILES notation for N-phenylhydroxylamine?
The canonical SMILES for N-phenylhydroxylamine is ONc1ccccc1.
What is the InChIKey of N-phenylhydroxylamine?
The InChIKey is CKRZKMFTZCFYGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO/c8-7-6-4-2-1-3-5-6/h1-5,7-8H.
What are the key properties of N-phenylhydroxylamine?
N-phenylhydroxylamine has a molecular weight of 109.13 g/mol, XLogP of 1.49, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenylhydroxylamine is sourced from PubChem (CID 7518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).