| CAS Number | 57402-46-7 |
| Catalog Number | AG003TVR(AGN-PC-0SNP4O) |
| Chemical Name | Potassium acetylacetonate hemihydrate |
| IUPAC Name | potassium;(Z)-4-oxopent-2-en-2-olate;hydrate |
| InChI | InChI=1S/C5H8O2.K.H2O/c1-4(6)3-5(2)7;;/h3,6H,1-2H3;;1H2/q;+1;/p-1/b4-3-;; |
| InChI Key | HXTFFCDNODNHAJ-GSBNXNDCSA-M |
| MDL Number | MFCD00013495 |
| Molecular Formula | C10H16K2O5 |
| Molecular Weight | 294.4276 |
| SMILES | [O-]C(=CC(=O)C)C.[K+].O |
| Synonyms | Potassium acetylacetonate hemihydrate,
57402-46-7,
Potassium 2,4-pentanedionate,
Potassium 2,4-pentanedionate hydrate,
MFCD00150167,
potassium (Z)-4-oxopent-2-en-2-olate hydrate,
POTASSIUMACETYLACETONATEHEMIHYDRATE,
2,4-Pentanedione, ion(1-), potassium, hemihydrate,
19393-11-4,
|
| Complexity | 107 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 156.019g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 156.222g/mol |
| Monoisotopic Mass | 156.019g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |   |
|
Hazard Class
|
6.1
|
|
Hazard statements
|
H302-H315-H319-H335-H350-H360
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P201-P261-P305+P351+P338-P308+P313
|
|
UN Code
|
UN 2811
|
Certificate of Analysis
Lot Number