| CAS Number | 1860017-96-4 |
| Catalog Number | AG00IKS3(AGN-PC-0WNGQ3) |
| Chemical Name | (2S)-2-methyl-5-phenylpyrrolidine |
| IUPAC Name | (2S)-2-methyl-5-phenylpyrrolidine |
| InChI | InChI=1S/C11H15N/c1-9-7-8-11(12-9)10-5-3-2-4-6-10/h2-6,9,11-12H,7-8H2,1H3/t9-,11?/m0/s1 |
| InChI Key | FTUSZADPSPPGFA-FTNKSUMCSA-N |
| MDL Number | MFCD29060178 |
| Molecular Formula | C11H15N |
| Molecular Weight | 161.2435 |
| SMILES | C[C@H]1CCC(N1)C1=CC=CC=C1 |
| Synonyms | (2S)-2-Methyl-5-phenylpyrrolidine,
1860017-96-4,
MFCD29060178,
AKOS027337233,
KS-0000055U,
AS-52479,
CS-0053437,
1357391-22-0,
na,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 161.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 161.248g/mol |
| Monoisotopic Mass | 161.12g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number