ethyl-(2-methylphenyl)diazene

C9H12N2 — CID 145391472

IUPACethyl-(2-methylphenyl)diazene
SMILESCC/N=N/c1ccccc1C
InChIInChI=1S/C9H12N2/c1-3-10-11-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3/b11-10+
InChIKeyGYFJQVNQOGNNKK-ZHACJKMWSA-N
MW148.21 g/mol
LogP3.10
Rot. Bonds2

About ethyl-(2-methylphenyl)diazene

ethyl-(2-methylphenyl)diazene (PubChem CID 145391472) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is ethyl-(2-methylphenyl)diazene.

Molecular Properties

Compound Nameethyl-(2-methylphenyl)diazene
PubChem CID145391472
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Nameethyl-(2-methylphenyl)diazene
SMILESCC/N=N/c1ccccc1C
InChIInChI=1S/C9H12N2/c1-3-10-11-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3/b11-10+
InChIKeyGYFJQVNQOGNNKK-ZHACJKMWSA-N
XLogP3.10
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 53.10
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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Related Compounds

ethane;(2-methylphenyl)-phenyldiazene;propane
CID 143988882
1-(aminodiazenyl)-2-methylbenzene
CID 21467423
ethanol;3-methyl-2-[(2-methylphenyl)diazenyl]aniline
CID 87488741
ethane;N-(2-methylphenyl)butan-2-imine
CID 142132579
N'-(2-methylphenyl)propanimidamide;dihydrochloride
CID 175785501
2,6-dimethyl-4-[(2-methylphenyl)diazenyl]phenol
CID 137240605
1-methyl-2-[2-[(2-methylphenyl)diazenyl]hydrazinyl]benzene
CID 25021273
N,N-dibenzyl-3-methyl-4-[[(2-methylphenyl)diazenyl]methyl]aniline
CID 54169249
1,2-xylene
CID 173422016
ethanamine;1,2-xylene
CID 160781195
(3-bromophenyl)-(2-methylphenyl)diazene
CID 563793
bis(2-methylaniline);propane
CID 158079245

Frequently Asked Questions

What is the IUPAC name of ethyl-(2-methylphenyl)diazene?
The IUPAC name of ethyl-(2-methylphenyl)diazene (CID 145391472) is ethyl-(2-methylphenyl)diazene.
What is the SMILES notation for ethyl-(2-methylphenyl)diazene?
The canonical SMILES for ethyl-(2-methylphenyl)diazene is CC/N=N/c1ccccc1C.
What is the InChIKey of ethyl-(2-methylphenyl)diazene?
The InChIKey is GYFJQVNQOGNNKK-ZHACJKMWSA-N. The full InChI is InChI=1S/C9H12N2/c1-3-10-11-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3/b11-10+.
What are the key properties of ethyl-(2-methylphenyl)diazene?
ethyl-(2-methylphenyl)diazene has a molecular weight of 148.21 g/mol, XLogP of 3.10, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-(2-methylphenyl)diazene is sourced from PubChem (CID 145391472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).