1-Acetyl-4-methylpiperazine
Basic information
- CAS
60787-05-5- Standard SMILES
CC(=O)N1CCN(C)CC1- InChIKey
YSDBJKNOEWSFGA-UHFFFAOYSA-N- Molecular formula
- C7H14N2O
- Average molar mass
- 142.2 g/mol
- Monoisotopic mass
- 142.11061307
Names & identifiers
- Preferred name
- 1-Acetyl-4-methylpiperazine
- IUPAC
- 1-(4-methylpiperazin-1-yl)ethanone
- English name
- 1-ACETYL-4-METHYLPIPERAZINE HYDROCHLORIDE
- Molecular formula
- C7H14N2O
- Molecular weight
- 142.2
Names & synonyms
1-Acetyl-4-methylpiperazineRefChem:74819YSDBJKNOEWSFGA-UHFFFAOYSA-N1-(4-methylpiperazin-1-yl)ethanone60787-05-5MFCD011953101-(4-methylpiperazin-1-yl)ethan-1-oneCHEMBL575239Piperazine, 1-acetyl-4-methyl-NCGC00024549-01Tocris-0351SCHEMBL33260
Show more names
1-Acetyl-4-methylpiperazineHCl1-(4-methyl-1-piperazinyl)EthanoneEthanone, 1-(4-methyl-1-piperazinyl)-1-ACETYL-4-METHYLPIPERAZINE HYDROCHLORIDE1-Acetyl-4-methylpiperazine Hydrocholride
SCHEMBL220868SCHEMBL2953594-methylpiperazinyl-1-oxoethaneDTXSID10902687BDBM50299723AKOS0038672171-(4-methyl-piperazin-1-yl)-ethanoneEthanone,1-(4-methyl-1-piperazinyl)-
Database identifiers
- CAS
60787-05-5- PubChem CID
- 550758
- DTXSID
DTXSID10902687- ChEMBL
CHEMBL575239- Nikkaji
- J354.568G
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 128
Physicochemical properties
- Melting point
- 280 °C · 280 °C (decomp)
- Boiling point
- 168 °C · 168 °C
- Density
- 1.017 · 1.017±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 6.84 · 6.84±0.10(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-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
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
Uses1-Acetyl-4-methylpiperazine Hydrochloride is used in the preparation of (acetyl)piperazinium iodide and pyrrolopyrazinium iodides as nicotinic agonists.
Upstream & downstream products
Upstream raw materials
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Related reactions
2 records
Compound notes
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