| CAS Number | 852329-53-4 |
| Catalog Number | AG00IDLC(AGN-PC-0WOJIC) |
| Chemical Name | (2S)-1-[2-(Cyclopentylamino)acetyl]pyrrolidine-2-boronic acid |
| IUPAC Name | [(2S)-1-[2-(cyclopentylamino)acetyl]pyrrolidin-2-yl]boronic acid |
| InChI | InChI=1S/C11H21BN2O3/c15-11(8-13-9-4-1-2-5-9)14-7-3-6-10(14)12(16)17/h9-10,13,16-17H,1-8H2/t10-/m1/s1 |
| InChI Key | FWAIOMYEQWSGSO-SNVBAGLBSA-N |
| MDL Number | MFCD18311827 |
| Molecular Formula | C11H21BN2O3 |
| Molecular Weight | 240.1070 |
| SMILES | OB([C@H]1CCCN1C(=O)CNC1CCCC1)O |
| Synonyms | (2S)-1-[2-(Cyclopentylamino)acetyl]pyrrolidine-2-boronic acid,
852329-53-4,
C11H21BN2O3,
MFCD18311827,
AKOS027372006,
ZINC169933845,
V9952,
B-8880,
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| Complexity | 269 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.165g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.11g/mol |
| Monoisotopic Mass | 240.165g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 72.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number