| CAS Number | 1019625-48-9 |
| Catalog Number | AG01AALC |
| Chemical Name | 1-[2-Fluoro-6-(2-methoxyethoxy)phenyl]ethan-1-one |
| IUPAC Name | 1-[2-fluoro-6-(2-methoxyethoxy)phenyl]ethanone |
| InChI | InChI=1S/C11H13FO3/c1-8(13)11-9(12)4-3-5-10(11)15-7-6-14-2/h3-5H,6-7H2,1-2H3 |
| InChI Key | IPRCBBQWTRWQNI-UHFFFAOYSA-N |
| MDL Number | MFCD11136922 |
| Molecular Formula | C11H13FO3 |
| Molecular Weight | 212.2175 |
| SMILES | COCCOC1=C(C(C)=O)C(F)=CC=C1 |
| Synonyms | 1-[2-fluoro-6-(2-methoxyethoxy)phenyl]ethan-1-one,
1019625-48-9,
AC1Q4GAC,
SCHEMBL8261358,
ZINC19871391,
AKOS000219515,
MCULE-7194368454,
NE45752,
EN300-68931,
Z1250132524,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.22g/mol |
| Monoisotopic Mass | 212.085g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
Lot Number