| CAS Number | 1314393-22-0 |
| Catalog Number | AG00HSGV(AGN-PC-0WG476) |
| Chemical Name | 2-AMINO-3-FLUORO-4,5-DIMETHOXYBENZAMIDE |
| IUPAC Name | 2-amino-3-fluoro-4,5-dimethoxybenzamide |
| InChI | InChI=1S/C9H11FN2O3/c1-14-5-3-4(9(12)13)7(11)6(10)8(5)15-2/h3H,11H2,1-2H3,(H2,12,13) |
| InChI Key | NKFOONRRXFWWGL-UHFFFAOYSA-N |
| MDL Number | MFCD20230584 |
| Molecular Formula | C9H11FN2O3 |
| Molecular Weight | 214.1936 |
| SMILES | COc1cc(C(=O)N)c(c(c1OC)F)N |
| Synonyms | 2-amino-3-fluoro-4,5-dimethoxybenzamide,
1314393-22-0,
SCHEMBL16689287,
NKFOONRRXFWWGL-UHFFFAOYSA-N,
MFCD20230584,
ZINC91305031,
AKOS027251308,
AM805891,
2-Amino-3-fluoro-4,5-dimethoxy-benzamide,
CS-0038590,
Benzamide, 2-amino-3-fluoro-4,5-dimethoxy-,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.196g/mol |
| Monoisotopic Mass | 214.075g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 87.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number