phenyldiazenylphosphonic acid

C6H7N2O3P — CID 118946462

IUPACphenyldiazenylphosphonic acid
SMILESO=P(O)(O)/N=N/c1ccccc1
InChIInChI=1S/C6H7N2O3P/c9-12(10,11)8-7-6-4-2-1-3-5-6/h1-5H,(H2,9,10,11)/b8-7+
InChIKeyLSULAVHPHBWDFC-BQYQJAHWSA-N
MW186.11 g/mol
LogP1.86
Rot. Bonds2

About phenyldiazenylphosphonic acid

phenyldiazenylphosphonic acid (PubChem CID 118946462) has the molecular formula C6H7N2O3P and a molecular weight of 186.11 g/mol. Its IUPAC name is phenyldiazenylphosphonic acid.

Molecular Properties

Compound Namephenyldiazenylphosphonic acid
PubChem CID118946462
Molecular FormulaC6H7N2O3P
Molecular Weight186.11 g/mol
Exact Mass186.02
IUPAC Namephenyldiazenylphosphonic acid
SMILESO=P(O)(O)/N=N/c1ccccc1
InChIInChI=1S/C6H7N2O3P/c9-12(10,11)8-7-6-4-2-1-3-5-6/h1-5H,(H2,9,10,11)/b8-7+
InChIKeyLSULAVHPHBWDFC-BQYQJAHWSA-N
XLogP1.86
TPSA82.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.11
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of phenyldiazenylphosphonic acid?
The IUPAC name of phenyldiazenylphosphonic acid (CID 118946462) is phenyldiazenylphosphonic acid.
What is the SMILES notation for phenyldiazenylphosphonic acid?
The canonical SMILES for phenyldiazenylphosphonic acid is O=P(O)(O)/N=N/c1ccccc1.
What is the InChIKey of phenyldiazenylphosphonic acid?
The InChIKey is LSULAVHPHBWDFC-BQYQJAHWSA-N. The full InChI is InChI=1S/C6H7N2O3P/c9-12(10,11)8-7-6-4-2-1-3-5-6/h1-5H,(H2,9,10,11)/b8-7+.
What are the key properties of phenyldiazenylphosphonic acid?
phenyldiazenylphosphonic acid has a molecular weight of 186.11 g/mol, XLogP of 1.86, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyldiazenylphosphonic acid is sourced from PubChem (CID 118946462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).