| CAS Number | 1334146-00-7 |
| Catalog Number | AG01AJKZ(AGN-PC-0WO0C1) |
| Chemical Name | 3-[(tert-butoxy)carbonyl]-2,2,5-trimethyl-1,3-oxazolidine-4-carboxylic acid |
| IUPAC Name | 2,2,5-trimethyl-3-[(2-methylpropan-2-yl)oxycarbonyl]-1,3-oxazolidine-4-carboxylic acid |
| InChI | InChI=1S/C12H21NO5/c1-7-8(9(14)15)13(12(5,6)17-7)10(16)18-11(2,3)4/h7-8H,1-6H3,(H,14,15) |
| InChI Key | ZOAFMGLANQGVKH-UHFFFAOYSA-N |
| MDL Number | MFCD19686273 |
| Molecular Formula | C12H21NO5 |
| Molecular Weight | 259.2988 |
| SMILES | CC1C(C(O)=O)N(C(OC(C)(C)C)=O)C(C)(C)O1 |
| Synonyms | 3-[(tert-butoxy)carbonyl]-2,2,5-trimethyl-1,3-oxazolidine-4-carboxylic acid,
1334146-00-7,
SCHEMBL15936851,
ZOAFMGLANQGVKH-UHFFFAOYSA-N,
AKOS026726173,
MCULE-6994003115,
NE30623,
EN300-80991,
Z1262237344,
3-(tert-butoxycarbonyl)-2,2,5-trimethyloxazolidine-4-carboxylic acid,
|
| Complexity | 358 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.141973g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 259.3g/mol |
| Monoisotopic Mass | 259.141973g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 76.1Ų |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number