4-(naphthalen-2-yldiazenyl)phenol

C16H12N2O — CID 135442096

IUPAC4-(naphthalen-2-yldiazenyl)phenol
SMILESOc1ccc(/N=N/c2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H12N2O/c19-16-9-7-14(8-10-16)17-18-15-6-5-12-3-1-2-4-13(12)11-15/h1-11,19H/b18-17+
InChIKeySDOPORHPKVAKOO-ISLYRVAYSA-N
MW248.28 g/mol
LogP4.96
Rot. Bonds2

About 4-(naphthalen-2-yldiazenyl)phenol

4-(naphthalen-2-yldiazenyl)phenol (PubChem CID 135442096) has the molecular formula C16H12N2O and a molecular weight of 248.28 g/mol. Its IUPAC name is 4-(naphthalen-2-yldiazenyl)phenol.

Molecular Properties

Compound Name4-(naphthalen-2-yldiazenyl)phenol
PubChem CID135442096
Molecular FormulaC16H12N2O
Molecular Weight248.28 g/mol
Exact Mass248.09
IUPAC Name4-(naphthalen-2-yldiazenyl)phenol
SMILESOc1ccc(/N=N/c2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H12N2O/c19-16-9-7-14(8-10-16)17-18-15-6-5-12-3-1-2-4-13(12)11-15/h1-11,19H/b18-17+
InChIKeySDOPORHPKVAKOO-ISLYRVAYSA-N
XLogP4.96
TPSA44.95 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 54.96
H-Bond Donors ≤ 51
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-(naphthalen-2-yldiazenyl)phenol?
The IUPAC name of 4-(naphthalen-2-yldiazenyl)phenol (CID 135442096) is 4-(naphthalen-2-yldiazenyl)phenol.
What is the SMILES notation for 4-(naphthalen-2-yldiazenyl)phenol?
The canonical SMILES for 4-(naphthalen-2-yldiazenyl)phenol is Oc1ccc(/N=N/c2ccc3ccccc3c2)cc1.
What is the InChIKey of 4-(naphthalen-2-yldiazenyl)phenol?
The InChIKey is SDOPORHPKVAKOO-ISLYRVAYSA-N. The full InChI is InChI=1S/C16H12N2O/c19-16-9-7-14(8-10-16)17-18-15-6-5-12-3-1-2-4-13(12)11-15/h1-11,19H/b18-17+.
What are the key properties of 4-(naphthalen-2-yldiazenyl)phenol?
4-(naphthalen-2-yldiazenyl)phenol has a molecular weight of 248.28 g/mol, XLogP of 4.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(naphthalen-2-yldiazenyl)phenol is sourced from PubChem (CID 135442096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).