| CAS Number | 1402454-41-4 |
| Catalog Number | AG00HVSJ(AGN-PC-0WG408) |
| Chemical Name | N-(3-(Difluoromethyl)phenyl)-N,O-dimethylhydroxylamine |
| IUPAC Name | 3-(difluoromethyl)-N-methoxy-N-methylbenzamide |
| InChI | InChI=1S/C10H11F2NO2/c1-13(15-2)10(14)8-5-3-4-7(6-8)9(11)12/h3-6,9H,1-2H3 |
| InChI Key | OOCUWXZFMCIGJB-UHFFFAOYSA-N |
| MDL Number | MFCD29917001 |
| Molecular Formula | C10H11F2NO2 |
| Molecular Weight | 215.1966 |
| SMILES | CON(C)C(=O)c1cccc(c1)C(F)F |
| Synonyms | 1402454-41-4,
N-(3-(Difluoromethyl)phenyl)-N,O-dimethylhydroxylamine,
3-(difluoromethyl)-N-methoxy-N-methylbenzamide,
SCHEMBL17134295,
MFCD28991804,
ZINC170921980,
CS-0035615,
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| Complexity | 224 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.2g/mol |
| Monoisotopic Mass | 215.076g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
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