Basic information
- Standard SMILES
O=C(CI)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1- InChIKey
BYMUWIFYMSRMOE-UHFFFAOYSA-N- Molecular formula
- C20H22INO2
- Average molar mass
- 435.3 g/mol
- Monoisotopic mass
- 435.06952694
Names & identifiers
- Preferred name
- Ketone, 4-(diphenylhydroxymethyl)piperidino iodomethyl
- IUPAC
- 1-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]-2-iodoethanone
Names & synonyms
KETONE, 4-(DIPHENYLHYDROXYMETHYL)PIPERIDINO IODOMETHYL143-86-2DTXSID70162280RefChem:1088006DTXCID0084771BRN 14968031-Iodoacetyl-alpha,alpha-diphenyl-4-piperidinemethanol4-Piperidinemethanol, 1-(iodoacetyl)-alpha,alpha-diphenyl-1-{4-[Hydroxydi(phenyl)methyl]piperidin-1-yl}-2-iodoethan-1-one
Database identifiers
- CAS
143-86-2- PubChem CID
- 8940
- DTXSID
DTXSID70162280- Nikkaji
- J71.220E
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 390
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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