| CAS Number | 1185299-59-5 |
| Catalog Number | AG01FO9Q(AGN-PC-0WBWAQ) |
| Chemical Name | 3-(4-Fluoro-2-methylphenoxy)pyrrolidine hydrochloride |
| IUPAC Name | 3-(4-fluoro-2-methylphenoxy)pyrrolidine;hydrochloride |
| InChI | InChI=1S/C11H14FNO.ClH/c1-8-6-9(12)2-3-11(8)14-10-4-5-13-7-10;/h2-3,6,10,13H,4-5,7H2,1H3;1H |
| InChI Key | HBZCUJSOMQVVND-UHFFFAOYSA-N |
| MDL Number | MFCD11506402 |
| Molecular Formula | C11H15ClFNO |
| Molecular Weight | 231.6943 |
| SMILES | Fc1ccc(c(c1)C)OC1CNCC1.Cl |
| Synonyms | 3-(4-FLUORO-2-METHYLPHENOXY)PYRROLIDINE HYDROCHLORIDE,
1185299-59-5,
3-(4-Fluoro-2-methylphenoxy)pyrrolidinehydrochloride,
CTK7B8677,
AKOS015849049,
TR-047561,
3-(4-Fluoro-2-methylphenoxy)pyrrolidine HCl,
946682-02-6,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.083g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.695g/mol |
| Monoisotopic Mass | 231.083g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number