3-(4-methyl-1H-pyrazol-1-yl)piperidine
Basic information
- CAS
1247747-56-3- Standard SMILES
Cc1cnn(C2CCCNC2)c1- InChIKey
FWDVJOKDANNSCK-UHFFFAOYSA-N- Molecular formula
- C9H15N3
- Average molar mass
- 165.24 g/mol
- Monoisotopic mass
- 165.12659749
Names & identifiers
- Preferred name
- 3-(4-methyl-1H-pyrazol-1-yl)piperidine
- IUPAC
- 3-(4-methylpyrazol-1-yl)piperidine
Names & synonyms
3-(4-methyl-1H-pyrazol-1-yl)piperidine1247747-56-3RefChem:493278970-446-73-(4-METHYLPYRAZOL-1-YL)PIPERIDINESCHEMBL2600281XZB74756AKOS010601891EN300-71197Z803130580
Database identifiers
- CAS
1247747-56-3- PubChem CID
- 54592641
- EC Number
- 970-446-7
- Nikkaji
- J3.092.609I
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 29.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 149
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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