| CAS Number | 1419101-44-2 |
| Catalog Number | AG001HDK(AGN-PC-0WCX8D) |
| Chemical Name | tert-butyl 3-(fluoromethyl)-3-hydroxypyrrolidine-1-carboxylate |
| IUPAC Name | tert-butyl 3-(fluoromethyl)-3-hydroxypyrrolidine-1-carboxylate |
| InChI | InChI=1S/C10H18FNO3/c1-9(2,3)15-8(13)12-5-4-10(14,6-11)7-12/h14H,4-7H2,1-3H3 |
| InChI Key | KGQUVLLKVOOYQB-UHFFFAOYSA-N |
| MDL Number | MFCD23106439 |
| Molecular Formula | C10H18FNO3 |
| Molecular Weight | 219.2532 |
| SMILES | O=C(N1CC(O)(CF)CC1)OC(C)(C)C |
| Synonyms | 1419101-44-2,
tert-butyl 3-(fluoromethyl)-3-hydroxypyrrolidine-1-carboxylate,
1-Boc-3-(fluoromethyl)-3-hydroxypyrrolidine,
MFCD23106439,
FCH2311336,
PB38840,
SB10853,
KS-0000044Y,
AK170823,
AS-33862,
CS-0048367,
1-Boc-3-(fluoromethyl)-3-hydroxypyrrolidine, AldrichCPR,
1-Pyrrolidinecarboxylic acid, 3-(fluoromethyl)-3-hydroxy-, 1,1-dimethylethyl ester,
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| Complexity | 252 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.256g/mol |
| Monoisotopic Mass | 219.127g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number