| CAS Number | 141734-32-9 |
| Catalog Number | AG01A0FR(AGN-PC-0PRAS1) |
| Chemical Name | Methyl 5-{[(tert-butoxy)carbonyl]amino}-3-oxopentanoate |
| IUPAC Name | methyl 5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopentanoate |
| InChI | InChI=1S/C11H19NO5/c1-11(2,3)17-10(15)12-6-5-8(13)7-9(14)16-4/h5-7H2,1-4H3,(H,12,15) |
| InChI Key | VVNVQQGRRYDFEP-UHFFFAOYSA-N |
| MDL Number | MFCD22578438 |
| Molecular Formula | C11H19NO5 |
| Molecular Weight | 245.2723 |
| SMILES | COC(=O)CC(=O)CCNC(=O)OC(C)(C)C |
| Synonyms | 141734-32-9,
methyl 5-{[(tert-butoxy)carbonyl]amino}-3-oxopentanoate,
5-tert-Butoxycarbonylamino-3-oxo-pentanoic acid methyl ester,
Methyl 5-((tert-butoxycarbonyl)amino)-3-oxopentanoate,
SCHEMBL3193384,
5-((tert-butoxycarbonyl)amino)-3-oxopentanoic acid methyl ester,
MFCD22578438,
ZINC59340677,
AKOS030230729,
MCULE-9816259428,
NE38216,
CS-0047208,
Z1520655653,
3-Oxo-5-(tert-butoxycarbonylamino)pentanoic acid methyl ester,
|
| Complexity | 293 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.275g/mol |
| Monoisotopic Mass | 245.126g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 81.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number