| CAS Number | 1257294-07-7 |
| Catalog Number | AG000OK0(AGN-PC-0WCJNX) |
| Chemical Name | Tert-butyl 3-(2-oxopyrrolidin-1-yl)azetidine-1-carboxylate |
| IUPAC Name | tert-butyl 3-(2-oxopyrrolidin-1-yl)azetidine-1-carboxylate |
| InChI | InChI=1S/C12H20N2O3/c1-12(2,3)17-11(16)13-7-9(8-13)14-6-4-5-10(14)15/h9H,4-8H2,1-3H3 |
| InChI Key | BEJHYAMGEUKMJA-UHFFFAOYSA-N |
| MDL Number | MFCD22123279 |
| Molecular Formula | C12H20N2O3 |
| Molecular Weight | 240.2988 |
| SMILES | CC(C)(C)OC(=O)N1CC(C1)N1CCCC1=O |
| Synonyms | 1257294-07-7,
tert-butyl 3-(2-oxopyrrolidin-1-yl)azetidine-1-carboxylate,
SCHEMBL2674657,
BEJHYAMGEUKMJA-UHFFFAOYSA-N,
ZINC72267093,
AKOS024438448,
AS-46579,
1-Boc-3-(2-Oxopyrrolidin-1-yl)azetidine,
tert-Butyl3-(2-oxopyrrolidin-1-yl)azetidine-1-carboxylate,
3-(2-Oxopyrrolidin-1-yl)azetidine-1-carboxylic acid tert-butyl ester,
1-Azetidinecarboxylic acid, 3-(2-oxo-1-pyrrolidinyl)-, 1,1-dimethylethyl ester,
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| Complexity | 329 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.303g/mol |
| Monoisotopic Mass | 240.147g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number