(4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone

C19H13FN2O — CID 132531231

IUPAC(4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone
SMILESO=C(c1ccc(F)cc1)c1ccccc1/N=N/c1ccccc1
InChIInChI=1S/C19H13FN2O/c20-15-12-10-14(11-13-15)19(23)17-8-4-5-9-18(17)22-21-16-6-2-1-3-7-16/h1-13H/b22-21+
InChIKeyZAOSXKMSYBSDFI-QURGRASLSA-N
MW304.32 g/mol
LogP5.47
Rot. Bonds4

About (4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone

(4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone (PubChem CID 132531231) has the molecular formula C19H13FN2O and a molecular weight of 304.32 g/mol. Its IUPAC name is (4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone
PubChem CID132531231
Molecular FormulaC19H13FN2O
Molecular Weight304.32 g/mol
Exact Mass304.10
IUPAC Name(4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone
SMILESO=C(c1ccc(F)cc1)c1ccccc1/N=N/c1ccccc1
InChIInChI=1S/C19H13FN2O/c20-15-12-10-14(11-13-15)19(23)17-8-4-5-9-18(17)22-21-16-6-2-1-3-7-16/h1-13H/b22-21+
InChIKeyZAOSXKMSYBSDFI-QURGRASLSA-N
XLogP5.47
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.32
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone?
The IUPAC name of (4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone (CID 132531231) is (4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone.
What is the SMILES notation for (4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone?
The canonical SMILES for (4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone is O=C(c1ccc(F)cc1)c1ccccc1/N=N/c1ccccc1.
What is the InChIKey of (4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone?
The InChIKey is ZAOSXKMSYBSDFI-QURGRASLSA-N. The full InChI is InChI=1S/C19H13FN2O/c20-15-12-10-14(11-13-15)19(23)17-8-4-5-9-18(17)22-21-16-6-2-1-3-7-16/h1-13H/b22-21+.
What are the key properties of (4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone?
(4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone has a molecular weight of 304.32 g/mol, XLogP of 5.47, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone is sourced from PubChem (CID 132531231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).