| CAS Number | 933758-97-5 |
| Catalog Number | AG019S1Y(AGN-PC-0WNL75) |
| Chemical Name | 3-[(Benzyloxy)Methyl]Pyrrolidine |
| IUPAC Name | 3-(phenylmethoxymethyl)pyrrolidine |
| InChI | InChI=1S/C12H17NO/c1-2-4-11(5-3-1)9-14-10-12-6-7-13-8-12/h1-5,12-13H,6-10H2 |
| InChI Key | RFOAPIACLKWTAY-UHFFFAOYSA-N |
| MDL Number | MFCD08686873 |
| Molecular Formula | C12H17NO |
| Molecular Weight | 191.2695 |
| SMILES | C(C1CNCC1)OCC1=CC=CC=C1 |
| Synonyms | 3-[(BENZYLOXY)METHYL]PYRROLIDINE,
933758-97-5,
CTK5J7763,
DTXSID30663066,
3600AF,
AKOS005263879,
MCULE-7769548991,
NE13971,
TR-047617,
EN300-91455,
Z1263544988,
C12H17NO,
N/A,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.274g/mol |
| Monoisotopic Mass | 191.131g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number