Basic information
- CAS
351039-00-4- Standard SMILES
CC(=O)c1ccc(N2CCC(C)CC2)c(F)c1- InChIKey
KABKVMCSWOIKRT-UHFFFAOYSA-N- Molecular formula
- C14H18FNO
- Average molar mass
- 235.3 g/mol
- Monoisotopic mass
- 235.13724236
Names & identifiers
- Preferred name
- 1-[3-Fluoro-4-(4-methylpiperidin-1-yl)phenyl]ethanone
- IUPAC
- 1-[3-fluoro-4-(4-methylpiperidin-1-yl)phenyl]ethanone
- English name
- ethanone, 1-[3-fluoro-4-(4-methyl-1-piperidinyl)phenyl]-
- Molecular formula
- C14H18FNO
- Molecular weight
- 235.3
Names & synonyms
351039-00-41-[3-fluoro-4-(4-methylpiperidin-1-yl)phenyl]ethanone1-(3-Fluoro-4-(4-methylpiperidin-1-yl)phenyl)ethanoneMFCD019099301-[3-fluoro-4-(4-methylpiperidin-1-yl)phenyl]ethan-1-one1-(3-Fluoro-4-(4-methylpiperidin-1-yl)phenyl)ethan-1-oneethanone, 1-[3-fluoro-4-(4-methyl-1-piperidinyl)phenyl]-MLS000709351CHEMBL1374806KABKVMCSWOIKRT-UHFFFAOYSA-NDTXSID401320596HMS2678G23
Show more names
ALBB-013106SMSF0010092STK742078AKOS000221412CB00791LS-04092SMR000290018ST038257
Database identifiers
- CAS
351039-00-4- PubChem CID
- 616481
- DTXSID
DTXSID401320596- ChEMBL
CHEMBL1374806
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 273
Experimental & physicochemical properties
Solubility6 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- 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.
Safety data
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers1 total
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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