| CAS Number | 913264-41-2 |
| Catalog Number | AG00IGLB(AGN-PC-0WBZLM) |
| Chemical Name | 4-(1-Hydroxyimino-2-methylpropylcarbamoyl)-piperidine-1-carboxylic acid tert-butyl ester |
| IUPAC Name | tert-butyl 4-[(N-hydroxy-C-propan-2-ylcarbonimidoyl)carbamoyl]piperidine-1-carboxylate |
| InChI | InChI=1S/C15H27N3O4/c1-10(2)12(17-21)16-13(19)11-6-8-18(9-7-11)14(20)22-15(3,4)5/h10-11,21H,6-9H2,1-5H3,(H,16,17,19) |
| InChI Key | HTJRCEYKHUSTMA-UHFFFAOYSA-N |
| MDL Number | MFCD30486381 |
| Molecular Formula | C15H27N3O4 |
| Molecular Weight | 313.3926 |
| SMILES | O/N=C(C(C)C)/NC(=O)C1CCN(CC1)C(=O)OC(C)(C)C |
| Synonyms | 913264-41-2,
tert-Butyl 4-((1-(hydroxyimino)-2-methylpropyl)carbamoyl)piperidine-1-carboxylate,
4-(1-HYDROXYIMINO-2-METHYLPROPYLCARBAMOYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER,
CTK8A5913,
CTK8F5248,
AKOS030232186,
|
| Complexity | 433 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 313.2g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 313.398g/mol |
| Monoisotopic Mass | 313.2g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 91.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number