| CAS Number | 81891-82-9 |
| Catalog Number | AG008LAA(AGN-PC-0C1EKG) |
| Chemical Name | Ethyl 2-carbamoyl-2,2-dimethylacetate |
| IUPAC Name | ethyl 3-amino-2,2-dimethyl-3-oxopropanoate |
| InChI | InChI=1S/C7H13NO3/c1-4-11-6(10)7(2,3)5(8)9/h4H2,1-3H3,(H2,8,9) |
| InChI Key | COYQHQNDYBZQJY-UHFFFAOYSA-N |
| MDL Number | MFCD20695491 |
| Molecular Formula | C7H13NO3 |
| Molecular Weight | 159.1830 |
| SMILES | CCOC(=O)C(C(=O)N)(C)C |
| Synonyms | 81891-82-9,
ETHYL 2-CARBAMOYL-2,2-DIMETHYLACETATE,
2-carboethoxy-2methylpropionamide,
Ethyl 3-amino-2,2-dimethyl-3-oxopropanoate,
SCHEMBL4187876,
CTK3E3771,
DTXSID20727904,
COYQHQNDYBZQJY-UHFFFAOYSA-N,
ZINC146877877,
2,2-dimethyl-malonamic acid ethyl ester,
Propanoic acid, 3-amino-2,2-dimethyl-3-oxo-, ethyl ester,
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| Complexity | 175 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.185g/mol |
| Monoisotopic Mass | 159.09g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 69.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number