| CAS Number | 2055119-09-8 |
| Catalog Number | AG00I3WK(AGN-PC-0WQZX7) |
| Chemical Name | 2,2-Difluoro-N,N-dimethyl-1,3-benzodioxole-5-carboxamide |
| IUPAC Name | 2,2-difluoro-N,N-dimethyl-1,3-benzodioxole-5-carboxamide |
| InChI | InChI=1S/C10H9F2NO3/c1-13(2)9(14)6-3-4-7-8(5-6)16-10(11,12)15-7/h3-5H,1-2H3 |
| InChI Key | WSPDWRAMZOJYPZ-UHFFFAOYSA-N |
| MDL Number | MFCD30527667 |
| Molecular Formula | C10H9F2NO3 |
| Molecular Weight | 229.1802 |
| SMILES | CN(C(=O)c1ccc2c(c1)OC(O2)(F)F)C |
| Synonyms | 2,2-Difluoro-N,N-dimethyl-1,3-benzodioxole-5-carboxamide,
2055119-09-8,
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| Complexity | 296 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.055g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.183g/mol |
| Monoisotopic Mass | 229.055g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
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