| CAS Number | 35454-04-7 |
| Catalog Number | AG019ETU(AGN-PC-0NJ0SI) |
| Chemical Name | 1-Amino-2-methyl-1-oxopropan-2-yl acetate |
| IUPAC Name | tert-butyl 2-amino-2-oxoacetate |
| InChI | InChI=1S/C6H11NO3/c1-6(2,3)10-5(9)4(7)8/h1-3H3,(H2,7,8) |
| InChI Key | ZQRDALWGTYZXQR-UHFFFAOYSA-N |
| MDL Number | MFCD19203739 |
| Molecular Formula | C6H11NO3 |
| Molecular Weight | 145.1564 |
| SMILES | CC(OC(C(N)=O)=O)(C)C |
| Synonyms | 35454-04-7,
Oxalamic Acid Tert-butyl Ester,
tert-butyl 2-amino-2-oxoacetate,
tert-butyl amino(oxo)acetate,
Acetic acid, aminooxo-, 1,1-dimethylethyl ester,
boc-carboxamide,
Boc-amino ketone,
t-Butyl 2-amino-2-oxoacetate,
SCHEMBL4325034,
CTK1B0562,
DTXSID20498920,
TERT-BUTYL CARBAMOYLFORMATE,
ZQRDALWGTYZXQR-UHFFFAOYSA-N,
MFCD19203739,
ZINC96029633,
AKOS006341366,
MCULE-7593631374,
CS-0060894,
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| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 145.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 145.158g/mol |
| Monoisotopic Mass | 145.074g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 69.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number