ethyl(phenyl)diazene

C8H10N2 — CID 12646258

IUPACethyl(phenyl)diazene
SMILESCC/N=N/c1ccccc1
InChIInChI=1S/C8H10N2/c1-2-9-10-8-6-4-3-5-7-8/h3-7H,2H2,1H3/b10-9+
InChIKeyDZJLKUUYWOFNOL-MDZDMXLPSA-N
MW134.18 g/mol
LogP2.79
Rot. Bonds2

About ethyl(phenyl)diazene

ethyl(phenyl)diazene (PubChem CID 12646258) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is ethyl(phenyl)diazene.

Molecular Properties

Compound Nameethyl(phenyl)diazene
PubChem CID12646258
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Nameethyl(phenyl)diazene
SMILESCC/N=N/c1ccccc1
InChIInChI=1S/C8H10N2/c1-2-9-10-8-6-4-3-5-7-8/h3-7H,2H2,1H3/b10-9+
InChIKeyDZJLKUUYWOFNOL-MDZDMXLPSA-N
XLogP2.79
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 52.79
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 ethyl(phenyl)diazene?
The IUPAC name of ethyl(phenyl)diazene (CID 12646258) is ethyl(phenyl)diazene.
What is the SMILES notation for ethyl(phenyl)diazene?
The canonical SMILES for ethyl(phenyl)diazene is CC/N=N/c1ccccc1.
What is the InChIKey of ethyl(phenyl)diazene?
The InChIKey is DZJLKUUYWOFNOL-MDZDMXLPSA-N. The full InChI is InChI=1S/C8H10N2/c1-2-9-10-8-6-4-3-5-7-8/h3-7H,2H2,1H3/b10-9+.
What are the key properties of ethyl(phenyl)diazene?
ethyl(phenyl)diazene has a molecular weight of 134.18 g/mol, XLogP of 2.79, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl(phenyl)diazene is sourced from PubChem (CID 12646258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).