| CAS Number | 1016499-34-5 |
| Catalog Number | AG01A7BI(AGN-PC-0WO0PR) |
| Chemical Name | 2-[(3-fluorophenyl)methyl]pyrrolidine |
| IUPAC Name | 2-[(3-fluorophenyl)methyl]pyrrolidine |
| InChI | InChI=1S/C11H14FN/c12-10-4-1-3-9(7-10)8-11-5-2-6-13-11/h1,3-4,7,11,13H,2,5-6,8H2 |
| InChI Key | MRXGOHHNQHZIDP-UHFFFAOYSA-N |
| MDL Number | MFCD09804749 |
| Molecular Formula | C11H14FN |
| Molecular Weight | 179.2340 |
| SMILES | FC1=CC(CC2NCCC2)=CC=C1 |
| Synonyms | 2-[(3-fluorophenyl)methyl]pyrrolidine,
1016499-34-5,
AC1Q4LN4,
CTK7C1838,
AKOS000153227,
AKOS022300635,
MCULE-6887036609,
NE30517,
EN300-58231,
Z969563942,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.238g/mol |
| Monoisotopic Mass | 179.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number