| CAS Number | 928063-81-4 |
| Catalog Number | AG01C995 |
| Chemical Name | (2S,3R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-methoxybutanoic acid |
| IUPAC Name | (2S,3R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methoxybutanoic acid |
| InChI | InChI=1S/C20H21NO5/c1-12(25-2)18(19(22)23)21-20(24)26-11-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,12,17-18H,11H2,1-2H3,(H,21,24)(H,22,23)/t12-,18+/m1/s1 |
| InChI Key | BOGQZFFOTLSMMA-XIKOKIGWSA-N |
| MDL Number | MFCD04973176 |
| Molecular Formula | C20H21NO5 |
| Molecular Weight | 355.3844 |
| SMILES | C[C@@H](OC)[C@H](NC(OCC2C1=C(C3=C2C=CC=C3)C=CC=C1)=O)C(O)=O |
| Synonyms | 928063-81-4,
(2S,3R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-methoxybutanoic acid,
SCHEMBL9289960,
ZINC2540543,
MFCD04973176,
AKOS027321468,
N-alpha-(9-Fluorenylmethyloxycarbonyl)-O-methyl-L-threonine,
(2S,3R)-3-Methoxy-2-(9H-fluorene-9-ylmethoxycarbonylamino)butanoic acid,
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| Complexity | 488 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 355.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 355.39g/mol |
| Monoisotopic Mass | 355.142g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 84.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
Lot Number