Basic information
- CAS
1016495-51-4- Standard SMILES
Cc1cccc(-c2nc(N)n[nH]2)c1C- InChIKey
JQBDYWGWGVQURW-UHFFFAOYSA-N- Molecular formula
- C10H12N4
- Average molar mass
- 188.23 g/mol
- Monoisotopic mass
- 188.1061964
Names & identifiers
- Preferred name
- 3-(2,3-Dimethylphenyl)-1H-1,2,4-triazol-5-amine
- IUPAC
- 5-(2,3-dimethylphenyl)-1H-1,2,4-triazol-3-amine
Names & synonyms
3-(2,3-Dimethylphenyl)-1H-1,2,4-triazol-5-amine1016495-51-45-Amino-3-(2,3-dimethylphenyl)-1H-1,2,4-triazole5-(2,3-DIMETHYLPHENYL)-4H-1,2,4-TRIAZOL-3-AMINEDTXSID601241067AKOS000148643SY361893
Database identifiers
- CAS
1016495-51-4- PubChem CID
- 20113048
- DTXSID
DTXSID601241067
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 67.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 197
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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