(2S,4R)-Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate
Grundinformationen
- CAS
120806-96-4- Standard-SMILES
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccccc1- InChIKey
QEQGWOLBDNOSAD-MNOVXSKESA-N- Summenformel
- C13H15NO4
- Durchschnittliche Molmasse
- 249,26 g/mol
- Monoisotopische Masse
- 249,10010796
Namen und Bezeichner
- Bevorzugter Name
- (2S,4R)-Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate
- IUPAC
- methyl (2S,4R)-1-benzoyl-4-hydroxypyrrolidine-2-carboxylate
- Englischer Name
- trans-1-Benzoyl-4-hydroxy-L-proline methyl ester
- Summenformel
- C13H15NO4
- Molmasse
- 249.26
Namen und Synonyme
(2S,4R)-Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate31560-20-0120806-96-4methyl (2S,4R)-1-benzoyl-4-hydroxypyrrolidine-2-carboxylateSCHEMBL2059306DTXSID90953536Methyl 1-benzoyl-4-hydroxyprolinateAKOS000278449AC-22525Methyl (4R)-1-benzoyl-4-hydroxy-L-prolinate(trans)-1-benzoyl-4-hydroxy-L-proline methyl ester(trans)-1-Benzoyl-4-hydroxy-L-proline, methyl ester
Weitere Namen anzeigen
N-Benzoylhydroxy-L-prolinmethylestercis-1-Benzoyl-4-hydro×y-L-prolineMethyl estertrans-1-Benzoyl-4-hydroxy-L-proline methyl esterTRANS-1-BENZOYL-4-HYDROXYL-L-PROLINE METHYL ESTERL-Proline, 1-benzoyl-4-hydroxy-, methyl ester, (4S)-TRANS-1-BENZOYL-4-HYDROXY-L-PROLINE METHYL ESTER USP/EP/BP(2S,4S)-Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate(2S,4R)-Methyl 4-hydro×y-1-benzoylpyrrolidine-2-carbo×ylate
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,9
- Polarare Oberfläche (TPSA)
- 66,8 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 18
- Formalladung
- 0
- Komplexität
- 325
Chemie und Industrie
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