| CAS Number | 1500059-86-8 |
| Catalog Number | AG01E7EO |
| Chemical Name | tert-butyl 2-[methyl(prop-2-yn-1-yl)amino]acetate |
| IUPAC Name | tert-butyl 2-[methyl(prop-2-ynyl)amino]acetate |
| InChI | InChI=1S/C10H17NO2/c1-6-7-11(5)8-9(12)13-10(2,3)4/h1H,7-8H2,2-5H3 |
| InChI Key | IZWDCIHJHOVGIQ-UHFFFAOYSA-N |
| MDL Number | MFCD30724102 |
| Molecular Formula | C10H17NO2 |
| Molecular Weight | 183.2475 |
| SMILES | CN(CC(OC(C)(C)C)=O)CC#C |
| Synonyms | ZINC308255650,
tert-Butyl 2-[methyl(prop-2-yn-1-yl)amino]acetate,
1500059-86-8,
|
| Complexity | 219 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.251g/mol |
| Monoisotopic Mass | 183.126g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
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