3-[4-(3-chlorophenyl)piperazin-1-yl]-1H-1,2,4-triazol-5-amine
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Basic information
- CAS
865657-91-6- Standard SMILES
Nc1nc(N2CCN(c3cccc(Cl)c3)CC2)n[nH]1- InChIKey
TYXDAJJVWKUJGI-UHFFFAOYSA-N- Molecular formula
- C12H15ClN6
- Average molar mass
- 278.747 g/mol
- Monoisotopic mass
- 278.10467216
Names & identifiers
- Preferred name
- 3-[4-(3-chlorophenyl)piperazin-1-yl]-1H-1,2,4-triazol-5-amine
- IUPAC
- 3-[4-(3-Chlorophenyl)piperazin-1-yl]-1H-1,2,4-triazol-5-amine
- English name
- 3-[4-(3-Chlorophenyl)piperazino]-1H-1,2,4-triazol-5-amine
- Molecular formula
- C12H15ClN6
- Molecular weight
- 278.74
Names & synonyms
3-[4-(3-Chlorophenyl)piperazino]-1H-1,2,4-triazol-5-amine3-[4-(3-CHLOROPHENYL)PIPERAZINO]-1H-1,2,4-TRIAZOL-5-YLAMINE1H-1,2,4-Triazol-3-amine, 5-[4-(3-chlorophenyl)-1-piperazinyl]-
Database identifiers
- CAS
865657-91-6- PubChem CID
- 1474429
- DTXSID
DTXSID301324414- ChEMBL
CHEMBL1305541
Properties
Physicochemical properties
- Boiling point
- 548.8 · 548.8±60.0 °C(Predicted)
- Density
- 1.422 · 1.422±0.06 g/cm3(Predicted)
- pka
- 12.73 · 12.73±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
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Related reactions
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Compound notes
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