RefChem:1098963
(Z)-but-2-enedioic acid;1-(spiro[1,3-dioxolane-2,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene]-4-ylmethyl)piperidine
Also Known As: 4'-Piperidinomethylspiro(5H-dibenzo(a,d)cycloheptene-5,2'-(1',3')dioxolane) maleate|Spiro(5H-dibenzo(a,d)cycloheptene-5,2'-(1',3')dioxolane), 4'-piperidinomethyl-, maleate|Piperidine, 1-(spiro[5H-dibenzo[a,d]cycloheptene-5,2'-[1,3]dioxolan]-4'-ylmethyl)-, (Z)-2-butenedioate (1:1)
| Molecular Formula | C27H29NO6 |
|---|---|
| Molecular Weight | 463.1995 g/mol |
| LogP | 3.9846 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 463.1995 |
| Monoisotopic Mass | 463.1995 |
| Heavy Atoms | 34 |
| Complexity | 1020.53284 |
Chemical Identifiers
| CAS Number | 34753-53-2 |
|---|---|
| SMILES | C1CCN(CC1)CC2COC3(O2)C4=CC=CC=C4C=CC5=CC=CC=C35.C(=C\C(=O)O)\C(=O)O |
Product Overview
RefChem:1098963 (CAS 34753-53-2), with molecular formula C27H29NO6 and molecular weight 463.1995 g/mol. IUPAC: (Z)-but-2-enedioic acid;1-(spiro[1,3-dioxolane-2,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene]-4-ylmethyl)piperidine.
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