4-[(4-methylphenyl)diazenyl]phenol

C13H12N2O — CID 2827322

IUPAC4-[(4-methylphenyl)diazenyl]phenol
SMILESCc1ccc(/N=N/c2ccc(O)cc2)cc1
InChIInChI=1S/C13H12N2O/c1-10-2-4-11(5-3-10)14-15-12-6-8-13(16)9-7-12/h2-9,16H,1H3/b15-14+
InChIKeyPLPWYNVDCPPLMM-CCEZHUSRSA-N
MW212.25 g/mol
LogP4.12
Rot. Bonds2

About 4-[(4-methylphenyl)diazenyl]phenol

4-[(4-methylphenyl)diazenyl]phenol (PubChem CID 2827322) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is 4-[(4-methylphenyl)diazenyl]phenol.

Molecular Properties

Compound Name4-[(4-methylphenyl)diazenyl]phenol
PubChem CID2827322
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC Name4-[(4-methylphenyl)diazenyl]phenol
SMILESCc1ccc(/N=N/c2ccc(O)cc2)cc1
InChIInChI=1S/C13H12N2O/c1-10-2-4-11(5-3-10)14-15-12-6-8-13(16)9-7-12/h2-9,16H,1H3/b15-14+
InChIKeyPLPWYNVDCPPLMM-CCEZHUSRSA-N
XLogP4.12
TPSA44.95 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 54.12
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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Related Compounds

bis(4-methylphenyl)diazene
CID 10389
4-methylphenol
CID 70549076
bis(4-methylphenol);tetrahydrochloride
CID 175346853
4-methylphenol;hydrate
CID 71777661
chromium;bis(4-methylphenol);chloride
CID 172752271
4-methylphenol;2-methylpropane
CID 91606636
ethane;4-(4-methylphenyl)phenol
CID 161379556
boric acid;4-methylphenol
CID 67912006
5-methyl-2-[(4-methylphenyl)diazenyl]phenol
CID 135467997
1,8-bis[(4-methylphenyl)diazenyl]naphthalene-2,7-diol
CID 136671063
2-methyl-4-[[4-[(4-methylphenyl)diazenyl]phenyl]diazenyl]phenol;molecular iodine
CID 159049808
4-[[2-[(4-hydroxyphenyl)diazenyl]phenyl]diazenyl]phenol
CID 174765894

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methylphenyl)diazenyl]phenol?
The IUPAC name of 4-[(4-methylphenyl)diazenyl]phenol (CID 2827322) is 4-[(4-methylphenyl)diazenyl]phenol.
What is the SMILES notation for 4-[(4-methylphenyl)diazenyl]phenol?
The canonical SMILES for 4-[(4-methylphenyl)diazenyl]phenol is Cc1ccc(/N=N/c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[(4-methylphenyl)diazenyl]phenol?
The InChIKey is PLPWYNVDCPPLMM-CCEZHUSRSA-N. The full InChI is InChI=1S/C13H12N2O/c1-10-2-4-11(5-3-10)14-15-12-6-8-13(16)9-7-12/h2-9,16H,1H3/b15-14+.
What are the key properties of 4-[(4-methylphenyl)diazenyl]phenol?
4-[(4-methylphenyl)diazenyl]phenol has a molecular weight of 212.25 g/mol, XLogP of 4.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methylphenyl)diazenyl]phenol is sourced from PubChem (CID 2827322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).