3-(4-Methylpiperazinomethyl)-2-norbornanone
Basic information
- CAS
71172-49-1- Standard SMILES
CN1CCN(CC2C(=O)C3CCC2C3)CC1- InChIKey
AZDLVOLXVIREKE-UHFFFAOYSA-N- Molecular formula
- C13H22N2O
- Average molar mass
- 222.33 g/mol
- Monoisotopic mass
- 222.17321333
Names & identifiers
- Preferred name
- 3-(4-Methylpiperazinomethyl)-2-norbornanone
- IUPAC
- 3-[(4-methylpiperazin-1-yl)methyl]bicyclo[2.2.1]heptan-2-one
- English name
- 3-(4-Methylpiperazinomethyl)-2-norbornanone
- Molecular formula
- C13H22N2O
- Molecular weight
- 222.33
Names & synonyms
3-(4-Methylpiperazinomethyl)-2-NorbornanoneRefChem:493342654-087-071172-49-13-[(4-methylpiperazin-1-yl)methyl]bicyclo[2.2.1]heptan-2-oneNSC 870773-((4-Methylpiperazin-1-yl)methyl)bicyclo[2.2.1]heptan-2-oneNSC87077SCHEMBL15181380DTXSID70293063NSC-87077AKOS024323394
Show more names
Bicyclo[2.2.1]heptan-2-one, 3-[(4-methyl-1-piperazinyl)methyl]-
ST50443897
Database identifiers
- CAS
71172-49-1- PubChem CID
- 258290
- DTXSID
DTXSID70293063- EC Number
- 654-087-0
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 284
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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