| CAS Number | 897043-85-5 |
| Catalog Number | AG00IFT2(AGN-PC-0WCKV6) |
| Chemical Name | Ethyl 1-Boc-3-methyl-4-oxopyrrolidine-3-carboxylate |
| IUPAC Name | 1-O-tert-butyl 3-O-ethyl 3-methyl-4-oxopyrrolidine-1,3-dicarboxylate |
| InChI | InChI=1S/C13H21NO5/c1-6-18-10(16)13(5)8-14(7-9(13)15)11(17)19-12(2,3)4/h6-8H2,1-5H3 |
| InChI Key | YDASEKAEWNKGEJ-UHFFFAOYSA-N |
| MDL Number | MFCD17012785 |
| Molecular Formula | C13H21NO5 |
| Molecular Weight | 271.3095 |
| SMILES | CCOC(=O)C1(C)CN(CC1=O)C(=O)OC(C)(C)C |
| Synonyms | 897043-85-5,
1-TERT-BUTYL 3-ETHYL 3-METHYL-4-OXOPYRROLIDINE-1,3-DICARBOXYLATE,
Ethyl 1-Boc-3-methyl-4-oxopyrrolidine-3-carboxylate,
SCHEMBL5509672,
MFCD17012785,
CS-W001675,
PB13708,
KS-0000078W,
AS-51146,
Q-1722,
1-tert-butyl3-ethyl3-methyl-4-oxopyrrolidine-1,3-dicarboxylate,
1-(tert-butyl) 3-ethyl 3-methyl-4-oxopyrrolidine-1,3-dicarboxylate,
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| Complexity | 398 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.313g/mol |
| Monoisotopic Mass | 271.142g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 72.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number