(2-Chloropyridin-3-yl)(4-methylpiperidin-1-yl)methanone
Basic information
- CAS
353258-80-7- Standard SMILES
CC1CCN(C(=O)c2cccnc2Cl)CC1- InChIKey
KOHQTMKPQJEEMF-UHFFFAOYSA-N- Molecular formula
- C12H15ClN2O
- Average molar mass
- 238.71 g/mol
- Monoisotopic mass
- 238.0872908
Names & identifiers
- Preferred name
- (2-Chloropyridin-3-yl)(4-methylpiperidin-1-yl)methanone
- IUPAC
- (2-chloro-3-pyridinyl)-(4-methylpiperidin-1-yl)methanone
- English name
- (2-Chloro-3-pyridinyl)(4-methyl-1-piperidinyl)-methanone
- Molecular formula
- C12H15ClN2O
- Molecular weight
- 238.71
Names & synonyms
353258-80-7(2-chloropyridin-3-yl)(4-methylpiperidin-1-yl)methanone(2-Chloro-3-pyridinyl)(4-methyl-1-piperidinyl)-methanone2-chloro-3-(4-methylpiperidine-1-carbonyl)pyridine(2-chloropyridin-3-yl)-(4-methylpiperidin-1-yl)methanone1-[(2-chloro-3-pyridinyl)carbonyl]-4-methylpiperidineOprea1_453099DPA25880MFCD02325412STK459422AKOS000163236CS-0252133
Show more names
Methanone, (2-chloro-3-pyridinyl)(4-methyl-1-piperidinyl)-
ST509258262-chloro(3-pyridyl) 4-methylpiperidyl ketoneEN300-59081G48208AI-204/31693030(2-chloro-3-pyridyl)-(4-methyl-1-piperidyl)methanoneZ32664990
Database identifiers
- CAS
353258-80-7- PubChem CID
- 901013
- EC Number
- 160-572-3
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 33.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 251
Physicochemical properties
- Boiling point
- 388.9 · 388.9±27.0 °C(Predicted)
- Density
- 1.195 · 1.195±0.06 g/cm3(Predicted)
- pka
- -0.63 · -0.63±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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