1-Methylsulfonyl-4-benzylpiperidine
Basic information
- CAS
132251-82-2- Standard SMILES
CS(=O)(=O)N1CCC(Cc2ccccc2)CC1- InChIKey
XDRPHPUMBKGZKY-UHFFFAOYSA-N- Molecular formula
- C13H19NO2S
- Average molar mass
- 253.36 g/mol
- Monoisotopic mass
- 253.11365002
Names & identifiers
- Preferred name
- 1-Methylsulfonyl-4-benzylpiperidine
- IUPAC
- 4-benzyl-1-methylsulfonylpiperidine
Names & synonyms
1-Methylsulfonyl-4-benzylpiperidine132251-82-2DTXSID80367067RefChem:232114DTXCID303181054-benzyl-1-(methylsulfonyl)piperidine4-Benzyl-1-(methanesulfonyl)piperidine4-benzyl-1-methylsulfonylpiperidine1-(methylsulfonyl)-4-benzylpiperidineCambridge id 5351181TimTec1_003074Oprea1_182545
Show more names
Oprea1_232181SCHEMBL9737540HMS1542L16STK096356AKOS000673323CCG-104719ST042662DB-329004
Database identifiers
- CAS
132251-82-2- PubChem CID
- 2223752
- DTXSID
DTXSID80367067- Nikkaji
- J2.678.353D
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 320
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Related reactions
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Compound notes
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