2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol

C14H14N2O2 — CID 136794284

IUPAC2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol
SMILESCc1ccc(/N=N/c2ccc(O)c(CO)c2)cc1
InChIInChI=1S/C14H14N2O2/c1-10-2-4-12(5-3-10)15-16-13-6-7-14(18)11(8-13)9-17/h2-8,17-18H,9H2,1H3/b16-15+
InChIKeyGLMFPOVAVDLFSS-FOCLMDBBSA-N
MW242.28 g/mol
LogP3.61
Rot. Bonds3

About 2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol

2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol (PubChem CID 136794284) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol.

Molecular Properties

Compound Name2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol
PubChem CID136794284
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol
SMILESCc1ccc(/N=N/c2ccc(O)c(CO)c2)cc1
InChIInChI=1S/C14H14N2O2/c1-10-2-4-12(5-3-10)15-16-13-6-7-14(18)11(8-13)9-17/h2-8,17-18H,9H2,1H3/b16-15+
InChIKeyGLMFPOVAVDLFSS-FOCLMDBBSA-N
XLogP3.61
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-(hydroxymethyl)-4-[(3-methylphenyl)diazenyl]phenol
CID 136794286
2-(hydroxymethyl)-4-[(4-nitrosophenyl)diazenyl]phenol
CID 136617946
4-[(3,4-dichlorophenyl)diazenyl]-2-(hydroxymethyl)phenol
CID 136794511
2-ethyl-4-[(4-methylphenyl)diazenyl]phenol;2-methylbutanoic acid
CID 136655699
2-(hydroxymethyl)-4-[(3-methoxyphenyl)diazenyl]phenol
CID 136794349
2-methyl-4-[[4-[(4-methylphenyl)diazenyl]phenyl]diazenyl]phenol;molecular iodine
CID 159049808
2-(hydroxymethyl)-4-isocyanatophenol
CID 163547093
4-[(3-ethynylphenyl)diazenyl]-2-(hydroxymethyl)phenol
CID 136791477
4-[(3-ethyl-4-hydroxyphenyl)diazenyl]-2-methylphenol
CID 163811607
bis(4-methylphenyl)diazene
CID 10389
1,8-bis[(4-methylphenyl)diazenyl]naphthalene-2,7-diol
CID 136671063
2-[2-hydroxy-5-[(3-methylphenyl)diazenyl]phenyl]acetic acid
CID 135843564

Frequently Asked Questions

What is the IUPAC name of 2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol?
The IUPAC name of 2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol (CID 136794284) is 2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol.
What is the SMILES notation for 2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol?
The canonical SMILES for 2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol is Cc1ccc(/N=N/c2ccc(O)c(CO)c2)cc1.
What is the InChIKey of 2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol?
The InChIKey is GLMFPOVAVDLFSS-FOCLMDBBSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-10-2-4-12(5-3-10)15-16-13-6-7-14(18)11(8-13)9-17/h2-8,17-18H,9H2,1H3/b16-15+.
What are the key properties of 2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol?
2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol has a molecular weight of 242.28 g/mol, XLogP of 3.61, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydroxymethyl)-4-[(4-methylphenyl)diazenyl]phenol is sourced from PubChem (CID 136794284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).