| CAS Number | 1205748-94-2 |
| Catalog Number | AG01ALR8 |
| Chemical Name | tert-butyl 3-formyl-3-methylazetidine-1-carboxylate |
| IUPAC Name | tert-butyl 3-formyl-3-methylazetidine-1-carboxylate |
| InChI | InChI=1S/C10H17NO3/c1-9(2,3)14-8(13)11-5-10(4,6-11)7-12/h7H,5-6H2,1-4H3 |
| InChI Key | AXFUKHQJEUFDJP-UHFFFAOYSA-N |
| MDL Number | MFCD14582393 |
| Molecular Formula | C10H17NO3 |
| Molecular Weight | 199.2469 |
| SMILES | C(=O)C1(CN(C1)C(=O)OC(C)(C)C)C |
| Synonyms | tert-butyl 3-formyl-3-methylazetidine-1-carboxylate,
1205748-94-2,
SCHEMBL14905814,
MFCD14582393,
ZINC219552795,
CS-0079100,
t-Butyl 3-formyl-3-methylazetidine-1-carboxylate,
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| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.25g/mol |
| Monoisotopic Mass | 199.121g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
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