(4-phenyldiazenylphenyl)methanol

C13H12N2O — CID 555490

IUPAC(4-phenyldiazenylphenyl)methanol
SMILESOCc1ccc(/N=N/c2ccccc2)cc1
InChIInChI=1S/C13H12N2O/c16-10-11-6-8-13(9-7-11)15-14-12-4-2-1-3-5-12/h1-9,16H,10H2/b15-14+
InChIKeyKDTXPUDCLDUROO-CCEZHUSRSA-N
MW212.25 g/mol
LogP3.59
Rot. Bonds3

About (4-phenyldiazenylphenyl)methanol

(4-phenyldiazenylphenyl)methanol (PubChem CID 555490) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is (4-phenyldiazenylphenyl)methanol.

Molecular Properties

Compound Name(4-phenyldiazenylphenyl)methanol
PubChem CID555490
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC Name(4-phenyldiazenylphenyl)methanol
SMILESOCc1ccc(/N=N/c2ccccc2)cc1
InChIInChI=1S/C13H12N2O/c16-10-11-6-8-13(9-7-11)15-14-12-4-2-1-3-5-12/h1-9,16H,10H2/b15-14+
InChIKeyKDTXPUDCLDUROO-CCEZHUSRSA-N
XLogP3.59
TPSA44.95 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 53.59
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

4-Aminobenzyl alcohol
CID 69331
4-Amino-alpha-methylbenzenemethanol
CID 85753
(4-Azidophenyl)methanol
CID 11171062
4-(Hydroxymethyl)benzenediazonium tetrafluoroborate
CID 21120209
4-(Hydroxymethyl)benzenediazonium
CID 122997
1-(4-(Hydroxymethyl)phenyl)guanidine
CID 17975425
(4-Amino-3-methylphenyl)methanol
CID 1514189
(1S)-1-(4-aminophenyl)ethan-1-ol
CID 6951270
4-Azidobenzeneethanol
CID 14892433
(4-Amino-2-fluorophenyl)methanol
CID 45116731
p-Hydroxymethylphenylhydrazine
CID 135538
(4-Aminophenyl)(phenyl)methanol
CID 242216

Frequently Asked Questions

What is the IUPAC name of (4-phenyldiazenylphenyl)methanol?
The IUPAC name of (4-phenyldiazenylphenyl)methanol (CID 555490) is (4-phenyldiazenylphenyl)methanol.
What is the SMILES notation for (4-phenyldiazenylphenyl)methanol?
The canonical SMILES for (4-phenyldiazenylphenyl)methanol is OCc1ccc(/N=N/c2ccccc2)cc1.
What is the InChIKey of (4-phenyldiazenylphenyl)methanol?
The InChIKey is KDTXPUDCLDUROO-CCEZHUSRSA-N. The full InChI is InChI=1S/C13H12N2O/c16-10-11-6-8-13(9-7-11)15-14-12-4-2-1-3-5-12/h1-9,16H,10H2/b15-14+.
What are the key properties of (4-phenyldiazenylphenyl)methanol?
(4-phenyldiazenylphenyl)methanol has a molecular weight of 212.25 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-phenyldiazenylphenyl)methanol is sourced from PubChem (CID 555490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).