[phenoxy(phosphanyl)amino]oxybenzene

C12H12NO2P — CID 67310968

IUPAC[phenoxy(phosphanyl)amino]oxybenzene
SMILESPN(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C12H12NO2P/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,16H2
InChIKeyPSZKNVMYNNLKKU-UHFFFAOYSA-N
MW233.21 g/mol
LogP3.07
Rot. Bonds4

About [phenoxy(phosphanyl)amino]oxybenzene

[phenoxy(phosphanyl)amino]oxybenzene (PubChem CID 67310968) has the molecular formula C12H12NO2P and a molecular weight of 233.21 g/mol. Its IUPAC name is [phenoxy(phosphanyl)amino]oxybenzene.

Molecular Properties

Compound Name[phenoxy(phosphanyl)amino]oxybenzene
PubChem CID67310968
Molecular FormulaC12H12NO2P
Molecular Weight233.21 g/mol
Exact Mass233.06
IUPAC Name[phenoxy(phosphanyl)amino]oxybenzene
SMILESPN(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C12H12NO2P/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,16H2
InChIKeyPSZKNVMYNNLKKU-UHFFFAOYSA-N
XLogP3.07
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.21
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [phenoxy(phosphanyl)amino]oxybenzene?
The IUPAC name of [phenoxy(phosphanyl)amino]oxybenzene (CID 67310968) is [phenoxy(phosphanyl)amino]oxybenzene.
What is the SMILES notation for [phenoxy(phosphanyl)amino]oxybenzene?
The canonical SMILES for [phenoxy(phosphanyl)amino]oxybenzene is PN(Oc1ccccc1)Oc1ccccc1.
What is the InChIKey of [phenoxy(phosphanyl)amino]oxybenzene?
The InChIKey is PSZKNVMYNNLKKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12NO2P/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,16H2.
What are the key properties of [phenoxy(phosphanyl)amino]oxybenzene?
[phenoxy(phosphanyl)amino]oxybenzene has a molecular weight of 233.21 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [phenoxy(phosphanyl)amino]oxybenzene is sourced from PubChem (CID 67310968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).