Ethyl (1R, 3R)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxylate - CAS 190957-31-4
Catalog: |
BB065647 |
Product Name: |
Ethyl (1R, 3R)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxylate |
CAS: |
190957-31-4 |
Synonyms: |
Ethyl (1R, 3R)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxylate; ETHYL (3R)-5-OXO-1-[(1R)-1-PHENYLETHYL]PYRROLIDINE-3-CARBOXYLATE; ethyl (3R)-5-oxo-1-[(1R)-1-phenylethyl]-3-pyrrolidinecarboxylate; Ethyl(1R,3R)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxylate |
IUPAC Name: | ethyl (3R)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate |
Description: | Ethyl (1R, 3R)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxylate |
Molecular Weight: | 261.32 |
Molecular Formula: | C15H19NO3 |
Canonical SMILES: | CCOC(=O)C1CC(=O)N(C1)C(C)C2=CC=CC=C2 |
InChI: | InChI=1S/C15H19NO3/c1-3-19-15(18)13-9-14(17)16(10-13)11(2)12-7-5-4-6-8-12/h4-8,11,13H,3,9-10H2,1-2H3/t11-,13-/m1/s1 |
InChI Key: | BIKRYOSLVLNBBR-DGCLKSJQSA-N |
Complexity: | 336 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 261.13649347 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 261.13649347 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 46.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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