(4-methylphenyl)methyl-phenyldiazene

C14H14N2 — CID 13049562

IUPAC(4-methylphenyl)methyl-phenyldiazene
SMILESCc1ccc(C/N=N/c2ccccc2)cc1
InChIInChI=1S/C14H14N2/c1-12-7-9-13(10-8-12)11-15-16-14-5-3-2-4-6-14/h2-10H,11H2,1H3/b16-15+
InChIKeyYTLLCEAFLBIYJH-FOCLMDBBSA-N
MW210.28 g/mol
LogP4.28
Rot. Bonds3

About (4-methylphenyl)methyl-phenyldiazene

(4-methylphenyl)methyl-phenyldiazene (PubChem CID 13049562) has the molecular formula C14H14N2 and a molecular weight of 210.28 g/mol. Its IUPAC name is (4-methylphenyl)methyl-phenyldiazene.

Molecular Properties

Compound Name(4-methylphenyl)methyl-phenyldiazene
PubChem CID13049562
Molecular FormulaC14H14N2
Molecular Weight210.28 g/mol
Exact Mass210.12
IUPAC Name(4-methylphenyl)methyl-phenyldiazene
SMILESCc1ccc(C/N=N/c2ccccc2)cc1
InChIInChI=1S/C14H14N2/c1-12-7-9-13(10-8-12)11-15-16-14-5-3-2-4-6-14/h2-10H,11H2,1H3/b16-15+
InChIKeyYTLLCEAFLBIYJH-FOCLMDBBSA-N
XLogP4.28
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-methylphenyl)methyl-phenyldiazene?
The IUPAC name of (4-methylphenyl)methyl-phenyldiazene (CID 13049562) is (4-methylphenyl)methyl-phenyldiazene.
What is the SMILES notation for (4-methylphenyl)methyl-phenyldiazene?
The canonical SMILES for (4-methylphenyl)methyl-phenyldiazene is Cc1ccc(C/N=N/c2ccccc2)cc1.
What is the InChIKey of (4-methylphenyl)methyl-phenyldiazene?
The InChIKey is YTLLCEAFLBIYJH-FOCLMDBBSA-N. The full InChI is InChI=1S/C14H14N2/c1-12-7-9-13(10-8-12)11-15-16-14-5-3-2-4-6-14/h2-10H,11H2,1H3/b16-15+.
What are the key properties of (4-methylphenyl)methyl-phenyldiazene?
(4-methylphenyl)methyl-phenyldiazene has a molecular weight of 210.28 g/mol, XLogP of 4.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylphenyl)methyl-phenyldiazene is sourced from PubChem (CID 13049562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).