(4-hydrazinylphenyl)phosphonic acid

C6H9N2O3P — CID 3062484

IUPAC(4-hydrazinylphenyl)phosphonic acid
SMILESNNc1ccc(P(=O)(O)O)cc1
InChIInChI=1S/C6H9N2O3P/c7-8-5-1-3-6(4-2-5)12(9,10)11/h1-4,8H,7H2,(H2,9,10,11)
InChIKeyKENFTUFPCZFECE-UHFFFAOYSA-N
MW188.12 g/mol
LogP-0.22
Rot. Bonds2

About (4-hydrazinylphenyl)phosphonic acid

(4-hydrazinylphenyl)phosphonic acid (PubChem CID 3062484) has the molecular formula C6H9N2O3P and a molecular weight of 188.12 g/mol. Its IUPAC name is (4-hydrazinylphenyl)phosphonic acid.

Molecular Properties

Compound Name(4-hydrazinylphenyl)phosphonic acid
PubChem CID3062484
Molecular FormulaC6H9N2O3P
Molecular Weight188.12 g/mol
Exact Mass188.04
IUPAC Name(4-hydrazinylphenyl)phosphonic acid
SMILESNNc1ccc(P(=O)(O)O)cc1
InChIInChI=1S/C6H9N2O3P/c7-8-5-1-3-6(4-2-5)12(9,10)11/h1-4,8H,7H2,(H2,9,10,11)
InChIKeyKENFTUFPCZFECE-UHFFFAOYSA-N
XLogP-0.22
TPSA95.58 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.12
LogP ≤ 5-0.22
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'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 (4-hydrazinylphenyl)phosphonic acid?
The IUPAC name of (4-hydrazinylphenyl)phosphonic acid (CID 3062484) is (4-hydrazinylphenyl)phosphonic acid.
What is the SMILES notation for (4-hydrazinylphenyl)phosphonic acid?
The canonical SMILES for (4-hydrazinylphenyl)phosphonic acid is NNc1ccc(P(=O)(O)O)cc1.
What is the InChIKey of (4-hydrazinylphenyl)phosphonic acid?
The InChIKey is KENFTUFPCZFECE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N2O3P/c7-8-5-1-3-6(4-2-5)12(9,10)11/h1-4,8H,7H2,(H2,9,10,11).
What are the key properties of (4-hydrazinylphenyl)phosphonic acid?
(4-hydrazinylphenyl)phosphonic acid has a molecular weight of 188.12 g/mol, XLogP of -0.22, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydrazinylphenyl)phosphonic acid is sourced from PubChem (CID 3062484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).