| CAS Number | 195136-67-5 |
| Catalog Number | AG00AE23(AGN-PC-0N8PDN) |
| Chemical Name | 2,4-Dimethoxy-3,5-difluorobenzenamine |
| IUPAC Name | 3,5-difluoro-2,4-dimethoxyaniline |
| InChI | InChI=1S/C8H9F2NO2/c1-12-7-4(9)3-5(11)8(13-2)6(7)10/h3H,11H2,1-2H3 |
| InChI Key | IWVNUSZUKBDACW-UHFFFAOYSA-N |
| MDL Number | MFCD12547867 |
| Molecular Formula | C8H9F2NO2 |
| Molecular Weight | 189.1594 |
| SMILES | COc1c(cc(c(c1F)OC)F)N |
| Synonyms | 3,5-Difluoro-2,4-dimethoxyaniline,
195136-67-5,
2,4-Dimethoxy-3,5-difluorobenzenamine,
1-amino-3,5-difluoro-2,4-dimethoxybenzene,
SCHEMBL6371958,
IWVNUSZUKBDACW-UHFFFAOYSA-N,
ZINC39168780,
AKOS006346336,
Z1741969094,
3,5-difluoro-2,4-dimethoxy-aniline,
CID10679192,
|
| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.06g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.162g/mol |
| Monoisotopic Mass | 189.06g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number