| CAS Number | 153529-18-1 |
| Catalog Number | AG00AR4Y(AGN-PC-0NKJGY) |
| Chemical Name | 2-(3-Fluorophenyl)-1-(4-methoxyphenyl)ethanone |
| IUPAC Name | 2-(3-fluorophenyl)-1-(4-methoxyphenyl)ethanone |
| InChI | InChI=1S/C15H13FO2/c1-18-14-7-5-12(6-8-14)15(17)10-11-3-2-4-13(16)9-11/h2-9H,10H2,1H3 |
| InChI Key | PGKAVRBAZXUZIY-UHFFFAOYSA-N |
| MDL Number | MFCD11545169 |
| Molecular Formula | C15H13FO2 |
| Molecular Weight | 244.2609 |
| SMILES | COC1=CC=C(C=C1)C(=O)CC1=CC(F)=CC=C1 |
| Synonyms | 2-(3-fluorophenyl)-1-(4-methoxyphenyl)ethanone,
153529-18-1,
2-(3-Fluorophenyl)-4'-methoxyacetophenone,
MFCD11545169,
ZINC37358428,
AKOS009348207,
SEL10362357,
AJ-93805,
AK159004,
PC421008,
PS-11064,
AX8292502,
ST2403898,
AS-813/43501874,
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| Complexity | 272 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.265g/mol |
| Monoisotopic Mass | 244.09g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number