| CAS Number | 1433995-57-3 |
| Catalog Number | AG00HWVB |
| Chemical Name | 1-Pyrrolidinecarboxylic acid, 2-ethyl-, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl 2-ethylpyrrolidine-1-carboxylate |
| InChI | InChI=1S/C11H21NO2/c1-5-9-7-6-8-12(9)10(13)14-11(2,3)4/h9H,5-8H2,1-4H3 |
| InChI Key | JWPIUFHZDRAHKC-UHFFFAOYSA-N |
| MDL Number | MFCD21105462 |
| Molecular Formula | C11H21NO2 |
| Molecular Weight | 199.2899 |
| SMILES | C(=O)(OC(C)(C)C)N1C(CC)CCC1 |
| Synonyms | tert-butyl 2-ethylpyrrolidine-1-carboxylate,
1433995-57-3,
AK161032,
SCHEMBL1467517,
MFCD21105462,
AKOS013101410,
t-Butyl 2-ethylpyrrolidine-1-carboxylate,
CS-0061468,
(R)-tert-butyl 2-ethylpyrrolidine-1-carboxylate,
N-tert-Butyloxycarbonyl-2-ethyl-pyrrolidine,
876617-06-0,
1279821-90-7,
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| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.157g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.294g/mol |
| Monoisotopic Mass | 199.157g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
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Certificate of Analysis
Lot Number