| CAS Number | 870262-20-7 |
| Catalog Number | AG01A24A(AGN-PC-0V9XZR) |
| Chemical Name | Methyl 2-(4-fluorophenyl)-2-hydroxypropanoate |
| IUPAC Name | methyl 2-(4-fluorophenyl)-2-hydroxypropanoate |
| InChI | InChI=1S/C10H11FO3/c1-10(13,9(12)14-2)7-3-5-8(11)6-4-7/h3-6,13H,1-2H3 |
| InChI Key | QIUYAFJJRJSELW-UHFFFAOYSA-N |
| MDL Number | MFCD16693863 |
| Molecular Formula | C10H11FO3 |
| Molecular Weight | 198.1909 |
| SMILES | COC(C(C1=CC=C(F)C=C1)(O)C)=O |
| Synonyms | methyl 2-(4-fluorophenyl)-2-hydroxypropanoate,
870262-20-7,
MFCD16693863,
AKOS011496099,
MCULE-9964475453,
NE50172,
CID11499388,
Methyl 2-(4-fluorophenyl)-2-hydroxy-propanoate,
|
| Complexity | 211 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 198.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.193g/mol |
| Monoisotopic Mass | 198.069g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number