| CAS Number | 1909310-11-7 |
| Catalog Number | AG01C376 |
| Chemical Name | potassium 5-hydroxy-5-phenylpentanoate |
| IUPAC Name | potassium;5-hydroxy-5-phenylpentanoate |
| InChI | InChI=1S/C11H14O3.K/c12-10(7-4-8-11(13)14)9-5-2-1-3-6-9;/h1-3,5-6,10,12H,4,7-8H2,(H,13,14);/q;+1/p-1 |
| InChI Key | FPPFIOYULOXZDB-UHFFFAOYSA-M |
| MDL Number | MFCD29060347 |
| Molecular Formula | C11H13KO3 |
| Molecular Weight | 232.3174 |
| SMILES | [K+].OC(C1=CC=CC=C1)CCCC([O-])=O |
| Synonyms | potassium 5-hydroxy-5-phenylpentanoate,
1909310-11-7,
AKOS030757635,
Z2327226160,
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.32g/mol |
| Monoisotopic Mass | 232.05g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 60.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number