4-Benzyl-1-(4-bromobenzoyl)piperidine
Basic information
- CAS
260428-71-5- Standard SMILES
O=C(c1ccc(Br)cc1)N1CCC(Cc2ccccc2)CC1- InChIKey
DVZAJQMGDDQZEQ-UHFFFAOYSA-N- Molecular formula
- C19H20BrNO
- Average molar mass
- 358.3 g/mol
- Monoisotopic mass
- 357.07283
Names & identifiers
- Preferred name
- 4-Benzyl-1-(4-bromobenzoyl)piperidine
- IUPAC
- (4-benzylpiperidin-1-yl)-(4-bromophenyl)methanone
- English name
- (4-benzylpiperidin-1-yl)-(4-bromophenyl)methanone
- Molecular formula
- C19H20BrNO
- Molecular weight
- 358.27
Names & synonyms
(4-benzylpiperidin-1-yl)(4-bromophenyl)methanoneCambridge id 5278202TimTec1_000911Oprea1_147879Oprea1_362026(4-benzylpiperidin-1-yl)-(4-bromophenyl)methanoneHMS1536J09STL2605264-bromophenyl 4-benzylpiperidyl ketoneAKOS0010177464-benzyl-1-(4-bromobenzoyl)piperidineNCGC00174991-01
Show more names
Methanone, (4-bromophenyl)[4-(phenylmethyl)-1-piperidinyl]-
ST011836BRD-K65528027-001-01-4Z30162336260428-71-5
Database identifiers
- CAS
260428-71-5- PubChem CID
- 984595
- EC Number
- 163-640-0
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 350
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
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, 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 CategoriesAquatic Acute 1 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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