| CAS Number | 951884-16-5 |
| Catalog Number | AG003S9I(AGN-PC-0WAE83) |
| Chemical Name | N-(2-Hydroxyethyl) 2-bromo-5-fluorobenzamide |
| IUPAC Name | 2-bromo-5-fluoro-N-(2-hydroxyethyl)benzamide |
| InChI | InChI=1S/C9H9BrFNO2/c10-8-2-1-6(11)5-7(8)9(14)12-3-4-13/h1-2,5,13H,3-4H2,(H,12,14) |
| InChI Key | JWEKNEISRBEANX-UHFFFAOYSA-N |
| MDL Number | MFCD09800913 |
| Molecular Formula | C9H9BrFNO2 |
| Molecular Weight | 262.0757 |
| SMILES | OCCNC(=O)c1cc(F)ccc1Br |
| Synonyms | 951884-16-5,
2-Bromo-5-fluoro-N-(2-hydroxyethyl)benzamide,
N-(2-Hydroxyethyl) 2-bromo-5-fluorobenzamide,
ACMC-209rvx,
CTK5H7469,
DTXSID70650495,
ANW-40411,
MFCD09800913,
SBB102495,
ZINC16159564,
AKOS009021337,
RTR-029688,
AJ-68702,
TR-029688,
N-(2-Hydroxyethyl)2-bromo-5-fluorobenzamide,
V9526,
B-4016,
I01-10706,
(2-bromo-5-fluorophenyl)-N-(2-hydroxyethyl)carboxamide,
C9H9BrFNO2,
2-Bromo-5-fluoro-N- Benzamide,
|
| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 260.98g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 262.078g/mol |
| Monoisotopic Mass | 260.98g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number