| CAS Number | 1935170-13-0 |
| Catalog Number | AG01BKAL |
| Chemical Name | 1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3-methylazetidine-3-carboxylic acid |
| IUPAC Name | 1-(9H-fluoren-9-ylmethoxycarbonyl)-3-methylazetidine-3-carboxylic acid |
| InChI | InChI=1S/C20H19NO4/c1-20(18(22)23)11-21(12-20)19(24)25-10-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,17H,10-12H2,1H3,(H,22,23) |
| InChI Key | YURGDOUBZIDRBV-UHFFFAOYSA-N |
| MDL Number | MFCD31559771 |
| Molecular Formula | C20H19NO4 |
| Molecular Weight | 337.3692 |
| SMILES | CC1(C(O)=O)CN(C(OCC2C3=C(C=CC=C3)C3=C2C=CC=C3)=O)C1 |
| Synonyms | 1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3-methylazetidine-3-carboxylic acid,
1935170-13-0,
|
| Complexity | 520 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 337.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 337.375g/mol |
| Monoisotopic Mass | 337.131g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
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