1-(2-Methoxyethyl)-5-oxo-2-phenylpyrrolidine-3-carboxylic acid - CAS 900641-25-0
Catalog: |
BB056480 |
Product Name: |
1-(2-Methoxyethyl)-5-oxo-2-phenylpyrrolidine-3-carboxylic acid |
CAS: |
900641-25-0 |
Synonyms: |
1-(2-METHOXYETHYL)-5-OXO-2-PHENYLPYRROLIDINE-3-CARBOXYLIC ACID; 1-(2-METHOXYETHYL)-5-OXO-2-PHENYLPYRROLIDINE-3-CARBOXYLICACID |
IUPAC Name: | 1-(2-methoxyethyl)-5-oxo-2-phenylpyrrolidine-3-carboxylic acid |
Description: | 1-(2-Methoxyethyl)-5-oxo-2-phenylpyrrolidine-3-carboxylic acid |
Molecular Weight: | 263.29 |
Molecular Formula: | C14H17NO4 |
Canonical SMILES: | COCCN1C(C(CC1=O)C(=O)O)C2=CC=CC=C2 |
InChI: | InChI=1S/C14H17NO4/c1-19-8-7-15-12(16)9-11(14(17)18)13(15)10-5-3-2-4-6-10/h2-6,11,13H,7-9H2,1H3,(H,17,18) |
InChI Key: | LWLDIFNJOLYNQS-UHFFFAOYSA-N |
Complexity: | 338 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.11575802 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 263.11575802 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 66.8Ų |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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