| CAS Number | 1086263-70-8 |
| Catalog Number | AG01C1IJ |
| Chemical Name | 3,4-bis(hydroxyimino)pentan-2-one |
| IUPAC Name | 3,4-bis(hydroxyimino)pentan-2-one |
| InChI | InChI=1S/C5H8N2O3/c1-3(6-9)5(7-10)4(2)8/h9-10H,1-2H3 |
| InChI Key | LIHSWVRROHJBFU-UHFFFAOYSA-N |
| MDL Number | MFCD29047324 |
| Molecular Formula | C5H8N2O3 |
| Molecular Weight | 144.1286 |
| SMILES | CC(C(C(C)=NO)=NO)=O |
| Synonyms | 3,4-bis(hydroxyimino)pentan-2-one,
1086263-70-8,
ZINC254765373,
MCULE-7630894531,
|
| Complexity | 195 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.13g/mol |
| Monoisotopic Mass | 144.053g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 82.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 2 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number