| CAS Number | 1198283-92-9 |
| Catalog Number | AG00HF4X |
| Chemical Name | Fmoc-4-(naphthalen-1-yl)-piperidine-4-carboxylic acid |
| IUPAC Name | 1-(9H-fluoren-9-ylmethoxycarbonyl)-4-naphthalen-1-ylpiperidine-4-carboxylic acid |
| InChI | InChI=1S/C31H27NO4/c33-29(34)31(28-15-7-9-21-8-1-2-10-22(21)28)16-18-32(19-17-31)30(35)36-20-27-25-13-5-3-11-23(25)24-12-4-6-14-26(24)27/h1-15,27H,16-20H2,(H,33,34) |
| InChI Key | LWIHHXOSAQLJHG-UHFFFAOYSA-N |
| MDL Number | MFCD12408087 |
| Molecular Formula | C31H27NO4 |
| Molecular Weight | 477.5504 |
| SMILES | C1CN(CCC1(C2=CC=CC3=CC=CC=C32)C(=O)O)C(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46 |
| Synonyms | 9-fluorenylmethoxycarbonyl-4-(naphthalen-1-yl)-piperidine-4-carboxylic acid,
fmoc-4-(naphthalen-1-yl)-piperidine-4-carboxylic acid,
Fmoc-4-(naphthalen-1-yl)-piperidine-4-carboxylic acid,
1198283-92-9,
MFCD12408087,
ZINC44122502,
Fmoc-4-(naphthalen-1-yl)-piperidine-4-carboxylic acid, AldrichCPR,
|
| Complexity | 782 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 477.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 36 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 477.56g/mol |
| Monoisotopic Mass | 477.194g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 6 |
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Certificate of Analysis
Lot Number