| CAS Number | 1268520-12-2 |
| Catalog Number | AG009YYE |
| Chemical Name | D-Proline, 1-acetyl-2-methyl- |
| IUPAC Name | (2R)-1-acetyl-2-methylpyrrolidine-2-carboxylic acid |
| InChI | InChI=1S/C8H13NO3/c1-6(10)9-5-3-4-8(9,2)7(11)12/h3-5H2,1-2H3,(H,11,12)/t8-/m1/s1 |
| InChI Key | VOSYPKQVDFIHEJ-MRVPVSSYSA-N |
| MDL Number | MFCD18632852 |
| Molecular Formula | C8H13NO3 |
| Molecular Weight | 171.1937 |
| SMILES | O=C([C@]1(C)N(C(C)=O)CCC1)O |
| Synonyms | D-Proline, 1-acetyl-2-methyl-,
1268520-12-2,
D-Proline,1-acetyl-2-methyl-,
(R)-1-acetyl-2-methylpyrrolidine-2-carboxylic acid,
SCHEMBL2682939,
ZINC70617653,
AKOS006371518,
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| Complexity | 226 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.196g/mol |
| Monoisotopic Mass | 171.09g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 57.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
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Certificate of Analysis
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