Basic information
- CAS
5014-86-8- Standard SMILES
Cc1ccccc1N=Nc1ccc(N)cc1C- InChIKey
KDDUERRSHIDEPP-UHFFFAOYSA-N- Molecular formula
- C14H15N3
- Average molar mass
- 225.29 g/mol
- Monoisotopic mass
- 225.12659748
Names & identifiers
- Preferred name
- 3-Methyl-4-(2-(2-methylphenyl)diazenyl)benzenamine
- IUPAC
- 3-methyl-4-[(2-methylphenyl)diazenyl]aniline
- English name
- 4-(o-tolylazo)-m-toluidine
- Molecular formula
- C14H15N3
- Molecular weight
- 225.289
Names & synonyms
5014-86-83-Methyl-4-(2-(2-methylphenyl)diazenyl)benzenamine3-Methyl-4-[2-(2-methylphenyl)diazenyl]benzenamineRefChem:2808744-(o-Tolylazo)-m-toluidineEINECS 225-693-9m-Toluidine, 4-(o-tolylazo)-3-methyl-4-[(2-methylphenyl)diazenyl]anilineCHEMBL81956SCHEMBL9319051SCHEMBL10409209KDDUERRSHIDEPP-UHFFFAOYSA-N
Show more names
3-Methyl-4-[(2-methylphenyl)azo]aniline
DTXSID001039076NS00046420Benzenamine, 3-methyl-4-[2-(2-methylphenyl)diazenyl]-
Database identifiers
- CAS
5014-86-8- PubChem CID
- 78713
- DTXSID
DTXSID001039076- ChEMBL
CHEMBL81956- EC Number
- 225-693-9
- Nikkaji
- J203.246E
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 264
Experimental & physicochemical properties
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Chemistry & industry
Suppliers1 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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