| CAS Number | 2108511-81-3 |
| Catalog Number | AG01DHTV |
| Chemical Name | TRANS-4-FLUORO-3-METHOXYPYRROLIDINE HCL |
| IUPAC Name | 3-fluoro-4-methoxypyrrolidine;hydrochloride |
| InChI | InChI=1S/C5H10FNO.ClH/c1-8-5-3-7-2-4(5)6;/h4-5,7H,2-3H2,1H3;1H |
| InChI Key | ZWYUPOATRRHOKQ-UHFFFAOYSA-N |
| MDL Number | MFCD23105900 |
| Molecular Formula | C5H11ClFNO |
| Molecular Weight | 155.5983 |
| SMILES | CO[C@H]1CNC[C@@H]1F.Cl |
| Synonyms | cis-3-Fluoro-4-methoxypyrrolidine hydrochloride,
2108511-81-3,
1638761-46-2,
trans-4-Fluoro-3-methoxypyrrolidine hydrochloride,
(3R,4R)-3-fluoro-4-methoxypyrrolidine hydrochloride,
(3S,4R)-3-Fluoro-4-methoxypyrrolidine hydrochloride,
1523530-49-5,
N/A,
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| Complexity | 78.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.597g/mol |
| Monoisotopic Mass | 155.051g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number