2-(diazenylmethyl)-4-methoxyphenol

C8H10N2O2 — CID 91523792

IUPAC2-(diazenylmethyl)-4-methoxyphenol
SMILES[H]/N=N/Cc1cc(OC)ccc1O
InChIInChI=1S/C8H10N2O2/c1-12-7-2-3-8(11)6(4-7)5-10-9/h2-4,9,11H,5H2,1H3/b10-9+
InChIKeyPRPRNTKZAQAPKL-MDZDMXLPSA-N
MW166.18 g/mol
LogP1.93
Rot. Bonds3

About 2-(diazenylmethyl)-4-methoxyphenol

2-(diazenylmethyl)-4-methoxyphenol (PubChem CID 91523792) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 2-(diazenylmethyl)-4-methoxyphenol.

Molecular Properties

Compound Name2-(diazenylmethyl)-4-methoxyphenol
PubChem CID91523792
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name2-(diazenylmethyl)-4-methoxyphenol
SMILES[H]/N=N/Cc1cc(OC)ccc1O
InChIInChI=1S/C8H10N2O2/c1-12-7-2-3-8(11)6(4-7)5-10-9/h2-4,9,11H,5H2,1H3/b10-9+
InChIKeyPRPRNTKZAQAPKL-MDZDMXLPSA-N
XLogP1.93
TPSA65.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(diazenylmethyl)-4-methoxyphenol?
The IUPAC name of 2-(diazenylmethyl)-4-methoxyphenol (CID 91523792) is 2-(diazenylmethyl)-4-methoxyphenol.
What is the SMILES notation for 2-(diazenylmethyl)-4-methoxyphenol?
The canonical SMILES for 2-(diazenylmethyl)-4-methoxyphenol is [H]/N=N/Cc1cc(OC)ccc1O.
What is the InChIKey of 2-(diazenylmethyl)-4-methoxyphenol?
The InChIKey is PRPRNTKZAQAPKL-MDZDMXLPSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-12-7-2-3-8(11)6(4-7)5-10-9/h2-4,9,11H,5H2,1H3/b10-9+.
What are the key properties of 2-(diazenylmethyl)-4-methoxyphenol?
2-(diazenylmethyl)-4-methoxyphenol has a molecular weight of 166.18 g/mol, XLogP of 1.93, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diazenylmethyl)-4-methoxyphenol is sourced from PubChem (CID 91523792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).