| CAS Number | 1217646-18-8 |
| Catalog Number | AG00HGDI |
| Chemical Name | (S)-(1-Fmoc-piperidin-3-yl)-acetic acid |
| IUPAC Name | 2-[(3S)-1-(9H-fluoren-9-ylmethoxycarbonyl)piperidin-3-yl]acetic acid |
| InChI | InChI=1S/C22H23NO4/c24-21(25)12-15-6-5-11-23(13-15)22(26)27-14-20-18-9-3-1-7-16(18)17-8-2-4-10-19(17)20/h1-4,7-10,15,20H,5-6,11-14H2,(H,24,25)/t15-/m0/s1 |
| InChI Key | JFQZUENRKJILBT-HNNXBMFYSA-N |
| MDL Number | MFCD09264215 |
| Molecular Formula | C22H23NO4 |
| Molecular Weight | 365.4223 |
| SMILES | OC(=O)C[C@H]1CN(CCC1)C(=O)OCC2C3=C(C=CC=C3)C4C2=CC=CC=4 |
| Synonyms | (S)-(1-Fmoc-piperidin-3-yl)-acetic acid,
1217646-18-8,
AC1LTQDW,
SCHEMBL1437435,
ZINC1433161,
MFCD09264215,
AKOS026671201,
(S)-(1-Fmoc-piperidin-3-yl)acetic acid,
A-8427,
2-[(3S)-1-(9H-fluoren-9-ylmethoxycarbonyl)piperidin-3-yl]acetic acid,
|
| Complexity | 528 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 365.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 365.429g/mol |
| Monoisotopic Mass | 365.163g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
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Certificate of Analysis
Lot Number