Piperidine, 1-((3a,12b-dihydrodibenzo(b,f)-1,3-dioxolo(4,5-d)oxepin-2-yl)methyl)-
Basic information
- CAS
84646-79-7- Standard SMILES
c1ccc2c(c1)Oc1ccccc1C1OC(CN3CCCCC3)OC21- InChIKey
LSDKLUSWTPTQEX-UHFFFAOYSA-N- Molecular formula
- C21H23NO3
- Average molar mass
- 337.4 g/mol
- Monoisotopic mass
- 337.1677936
Names & identifiers
- Preferred name
- Piperidine, 1-((3a,12b-dihydrodibenzo(b,f)-1,3-dioxolo(4,5-d)oxepin-2-yl)methyl)-
- IUPAC
- 1-(3,5,13-trioxatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),7,9,11,14,16-hexaen-4-ylmethyl)piperidine
- English name
- Piperidine, 1-((3a,12b-dihydrodibenzo(b,f)-1,3-dioxolo(4,5-d)oxepin-2- yl)methyl)-
- Molecular weight
- 0
Names & synonyms
84646-79-71-((3a,12b-Dihydrodibenzo(b,f)-1,3-dioxolo(4,5-d)oxepin-2-yl)methyl)piperidine2-(Piperidinomethyl)dibenz(2,3:6,7)-3a,12b-dihydrooxepin(4,5-d)-1,3-dioxolanePiperidine, 1-((3a,12b-dihydrodibenzo(b,f)-1,3-dioxolo(4,5-d)oxepin-2-yl)methyl)-RefChem:372847DTXSID2010049361-[(3a,12b-Dihydro-2H-dibenzo[b,f][1,3]dioxolo[4,5-d]oxepin-2-yl)methyl]piperidinePiperidine, 1-((3a,12b-dihydrodibenzo(b,f)-1,3-dioxolo(4,5-d)oxepin-2- yl)methyl)-
Database identifiers
- CAS
84646-79-7- PubChem CID
- 3069412
- DTXSID
DTXSID201004936
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 30.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 422
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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