| CAS Number | 1546459-72-6 |
| Catalog Number | AG01BNVM |
| Chemical Name | 2-[(4-fluoro-3-methylphenyl)methyl]oxirane |
| IUPAC Name | 2-[(4-fluoro-3-methylphenyl)methyl]oxirane |
| InChI | InChI=1S/C10H11FO/c1-7-4-8(2-3-10(7)11)5-9-6-12-9/h2-4,9H,5-6H2,1H3 |
| InChI Key | GODATNLOVBIVNU-UHFFFAOYSA-N |
| MDL Number | MFCD24203734 |
| Molecular Formula | C10H11FO |
| Molecular Weight | 166.1921 |
| SMILES | CC1=C(F)C=CC(CC2OC2)=C1 |
| Synonyms | 2-[(4-fluoro-3-methylphenyl)methyl]oxirane,
1546459-72-6,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.195g/mol |
| Monoisotopic Mass | 166.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
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Certificate of Analysis
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