diphenyldiazene

C12H10N2 — CID 2272

IUPACdiphenyldiazene
SMILESc1ccc(/N=N/c2ccccc2)cc1
InChIInChI=1S/C12H10N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1-10H/b14-13+
InChIKeyDMLAVOWQYNRWNQ-BUHFOSPRSA-N
MW182.23 g/mol
LogP4.10
Rot. Bonds2

About diphenyldiazene

diphenyldiazene (PubChem CID 2272) has the molecular formula C12H10N2 and a molecular weight of 182.23 g/mol. Its IUPAC name is diphenyldiazene.

Molecular Properties

Compound Namediphenyldiazene
PubChem CID2272
Molecular FormulaC12H10N2
Molecular Weight182.23 g/mol
Exact Mass182.08
IUPAC Namediphenyldiazene
SMILESc1ccc(/N=N/c2ccccc2)cc1
InChIInChI=1S/C12H10N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1-10H/b14-13+
InChIKeyDMLAVOWQYNRWNQ-BUHFOSPRSA-N
XLogP4.10
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 54.10
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 diphenyldiazene?
The IUPAC name of diphenyldiazene (CID 2272) is diphenyldiazene.
What is the SMILES notation for diphenyldiazene?
The canonical SMILES for diphenyldiazene is c1ccc(/N=N/c2ccccc2)cc1.
What is the InChIKey of diphenyldiazene?
The InChIKey is DMLAVOWQYNRWNQ-BUHFOSPRSA-N. The full InChI is InChI=1S/C12H10N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1-10H/b14-13+.
What are the key properties of diphenyldiazene?
diphenyldiazene has a molecular weight of 182.23 g/mol, XLogP of 4.10, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyldiazene is sourced from PubChem (CID 2272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).