Piperidine, 1-(3-iodobenzoyl)-
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Basic information
- CAS
121114-31-6- Standard SMILES
O=C(c1cccc(I)c1)N1CCCCC1- InChIKey
VZBNRYSPDWCBGH-UHFFFAOYSA-N- Molecular formula
- C12H14INO
- Average molar mass
- 315.15 g/mol
- Monoisotopic mass
- 315.01201
Names & identifiers
- Preferred name
- Piperidine, 1-(3-iodobenzoyl)-
- IUPAC
- (3-iodophenyl)-piperidin-1-ylmethanone
- English name
- 1-[(3-iodophenyl)carbonyl]piperidine
- Molecular formula
- C12H14INO
- Molecular weight
- 315.15013
Names & synonyms
Piperidine, 1-(3-iodobenzoyl)-121114-31-6(3-iodophenyl)-piperidin-1-ylmethanone1-[(3-iodophenyl)carbonyl]piperidineSCHEMBL7906862DTXSID40357000AKOS000620647(3-Iodophenyl)(piperidin-1-yl)methanoneAG-690/40116472SR-01000313150SR-01000313150-1
Database identifiers
- CAS
121114-31-6- PubChem CID
- 839960
- DTXSID
DTXSID40357000
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 226
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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