4-Piperidinol, 4-(p-chlorophenyl)-1-(2-(2-methyl-1,3-benzodioxol-2-yl)ethyl)-, hydrochloride
Basic information
- CAS
52502-60-0- Standard SMILES
CC1(CCN2CCC(O)(c3ccc(Cl)cc3)CC2)Oc2ccccc2O1.Cl- InChIKey
VOUSTVWCTGNPPU-UHFFFAOYSA-N- Molecular formula
- C21H25Cl2NO3
- Average molar mass
- 410.3 g/mol
- Monoisotopic mass
- 409.121149
Names & identifiers
- Preferred name
- 4-Piperidinol, 4-(p-chlorophenyl)-1-(2-(2-methyl-1,3-benzodioxol-2-yl)ethyl)-, hydrochloride
- IUPAC
- 4-(4-chlorophenyl)-1-[2-(2-methyl-1,3-benzodioxol-2-yl)ethyl]piperidin-4-ol;hydrochloride
Names & synonyms
NSC 30386352502-60-04-Piperidinol, 4-(p-chlorophenyl)-1-(2-(2-methyl-1,3-benzodioxol-2-yl)ethyl)-, hydrochlorideDTXSID602005094-(p-Chlorophenyl)-1-(2-(2-methyl-1,3-benzodioxol-2-yl)ethyl)-4-piperidinol hydrochlorideRefChem:295836DTXCID40123000NSC-303863P4FK97WE2KNSC303863DS-0055014-(4-chlorophenyl)-1-[2-(2-methyl-2H-1,3-benzodioxol-2-yl)ethyl]piperidin-4-ol hydrochloride
Show more names
4-(4-Chlorophenyl)-1-[2-(2-methyl-2H-1,3-benzodioxol-2-yl)ethyl]piperidin-4-ol--hydrogen chloride (1/1)4-Piperidinol, 4-(4-chlorophenyl)-1-[2-(2-methyl-1,3-benzodioxol-2-yl)ethyl]-, hydrochloride (1:1)
Database identifiers
- CAS
52502-60-0- PubChem CID
- 3040593
- DTXSID
DTXSID60200509- UNII
- P4FK97WE2K
Properties
Computed structural properties
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 458
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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