| CAS Number | 1379588-43-8 |
| Catalog Number | AG01BUSL(AGN-PC-0WA2KT) |
| Chemical Name | (3R)-3-(3-chlorophenoxy)pyrrolidine |
| IUPAC Name | (3R)-3-(3-chlorophenoxy)pyrrolidine |
| InChI | InChI=1S/C10H12ClNO/c11-8-2-1-3-9(6-8)13-10-4-5-12-7-10/h1-3,6,10,12H,4-5,7H2/t10-/m1/s1 |
| InChI Key | NDJXJUSKVNUOOH-SNVBAGLBSA-N |
| MDL Number | MFCD22385146 |
| Molecular Formula | C10H12ClNO |
| Molecular Weight | 197.6614 |
| SMILES | ClC1=CC(O[C@H]2CNCC2)=CC=C1 |
| Synonyms | (3R)-3-(3-chlorophenoxy)pyrrolidine,
1379588-43-8,
ZINC14632167,
pyrrolidine, 3-(3-chlorophenoxy)-, (3r)-,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.662g/mol |
| Monoisotopic Mass | 197.061g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
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