N,N'-(Azanediylbis((11bR)-2,6-di(naphthalen-2-yl)-4l5-dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepine-4-yl-4-ylidene))bis(1,1,1-trifluoromethanesulfonamide)
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CAS Number 2016814-96-1
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Catalog Number io-406905
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Molecular Weight 1444.3000
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SMILES
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No description available for this item
| 1 | SCHEMBL18598243 |
| 2 | N,N'-(Azanediylbis((11bR)-2,6-di(naphthalen-2-yl)-4l5-dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepine-4-yl-4-ylidene))bis(1,1,1-trifluoromethanesulfonamide) |
| Molecular Formula | C82H49F6N3O8P2S2 |
|---|---|
| Canonical SMILES | |
| Isomeric SMILES | |
| Molecular Weight | 1444.3000 |
| InChIKey | XJULGUDVCGYXED-UHFFFAOYSA-N |
| InChI | InChI=1S/C82H49F6N3O8P2S2/c83-81(84,85)102(92,93)90-100(96-77-69(61-37-33-49-17-1-5-21-53(49)41-61)45-57-25-9-13-29-65(57)73(77)74-66-30-14-10-26-58(66)46-70(78(74)97-100)62-38-34-50-18-2-6-22-54(50)42-62)89-101(91-103(94,95)82(86,87)88)98-79-71(63-39-35-51-19-3-7-23-55(51)43-63)47-59-27-11-15-31-67(59)75(79)76-68-32-16-12-28-60(68)48-72(80(76)99-101)64-40-36-52-20-4-8-24-56(52)44-64/h1-48,89H |
| XLogP | 25.7000 |
| ExactMass | 1443.2341 |
| MonoisotopicMass | 1443.2341 |
| TPSA | 159.0000 |
| Complexity | 2980.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 1 |
| HBondAcceptorCount | 17 |
| RotatableBondCount | 8 |
| HeavyAtomCount | 103 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 2 |
| PatentFamilyCount | 1 |
| LiteratureCount | 0 |
