| CAS Number | 1245563-16-9 |
| Catalog Number | AG000M7K(AGN-PC-0WAEMR) |
| Chemical Name | N-Methyl 4-bromo-2-ethoxybenzamide |
| IUPAC Name | 4-bromo-2-ethoxy-N-methylbenzamide |
| InChI | InChI=1S/C10H12BrNO2/c1-3-14-9-6-7(11)4-5-8(9)10(13)12-2/h4-6H,3H2,1-2H3,(H,12,13) |
| InChI Key | BATTWSDSGWAEMC-UHFFFAOYSA-N |
| MDL Number | MFCD17015774 |
| Molecular Formula | C10H12BrNO2 |
| Molecular Weight | 258.1118 |
| SMILES | CCOc1cc(Br)ccc1C(=O)NC |
| Synonyms | 1245563-16-9,
4-Bromo-2-ethoxy-N-methylbenzamide,
N-METHYL 4-BROMO-2-ETHOXYBENZAMIDE,
ACMC-209ash,
CTK4B3978,
DTXSID40681832,
N-methyl-4-bromo-2-ethoxybenzamide,
ANW-18255,
MFCD17015774,
ZINC65337021,
AKOS015835575,
FCH1351955,
Benzamide, 4-bromo-2-ethoxy-N-methyl-,
AJ-114963,
AX8242901,
TR-035057,
Z8795,
B-2355,
I01-10911,
C10H12BrNO2,
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| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.005g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.115g/mol |
| Monoisotopic Mass | 257.005g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number