| CAS Number | 1564677-76-4 |
| Catalog Number | AG01EKFE(AGN-PC-0WOFCA) |
| Chemical Name | 2-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2,3-dihydro-1H-isoindole-5-carboxylic acid |
| IUPAC Name | 2-(9H-fluoren-9-ylmethoxycarbonyl)-1,3-dihydroisoindole-5-carboxylic acid |
| InChI | InChI=1S/C24H19NO4/c26-23(27)15-9-10-16-12-25(13-17(16)11-15)24(28)29-14-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-11,22H,12-14H2,(H,26,27) |
| InChI Key | LLDDMZGYILWGLP-UHFFFAOYSA-N |
| MDL Number | MFCD25980426 |
| Molecular Formula | C24H19NO4 |
| Molecular Weight | 385.4120 |
| SMILES | O=C(O)C1=CC=C2C(=C1)CN(C(=O)OCC3C=4C=CC=CC4C=5C=CC=CC53)C2 |
| Synonyms | AKOS026739364,
2-[(9H-fluoren-9-ylmethoxy)carbonyl]-2,3-dihydro-1H-isoindole-5-carboxylic acid,
1564677-76-4,
|
| Complexity | 614 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 385.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 385.419g/mol |
| Monoisotopic Mass | 385.131g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
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