| CAS Number | 1249952-01-9 |
| Catalog Number | AG01EJCB |
| Chemical Name | ETHYL 3-AMINO-3-(OXAN-4-YL)PROPANOATE |
| IUPAC Name | ethyl 3-amino-3-(oxan-4-yl)propanoate |
| InChI | InChI=1S/C10H19NO3/c1-2-14-10(12)7-9(11)8-3-5-13-6-4-8/h8-9H,2-7,11H2,1H3 |
| InChI Key | PTZXLMBRCWSZHK-UHFFFAOYSA-N |
| MDL Number | MFCD16745949 |
| Molecular Formula | C10H19NO3 |
| Molecular Weight | 201.2628 |
| SMILES | CCOC(CC(C1CCOCC1)N)=O |
| Synonyms | AKOS011673419,
ethyl 3-amino-3-(oxan-4-yl)propanoate,
1249952-01-9,
|
| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.266g/mol |
| Monoisotopic Mass | 201.136g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 61.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
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