| CAS Number | 1345472-12-9 |
| Catalog Number | AG007ZXQ(AGN-PC-0WA4GS) |
| Chemical Name | 1-Bromo-3-fluoro-2-(morpholinomethyl)benzene |
| IUPAC Name | 4-[(2-bromo-6-fluorophenyl)methyl]morpholine |
| InChI | InChI=1S/C11H13BrFNO/c12-10-2-1-3-11(13)9(10)8-14-4-6-15-7-5-14/h1-3H,4-8H2 |
| InChI Key | CWQNAYDNRWPWBM-UHFFFAOYSA-N |
| MDL Number | MFCD20441936 |
| Molecular Formula | C11H13BrFNO |
| Molecular Weight | 274.1294 |
| SMILES | c1ccc(c(c1Br)CN1CCOCC1)F |
| Synonyms | 1-Bromo-3-fluoro-2-(morpholinomethyl)benzene,
1345472-12-9,
4-[(2-bromo-6-fluorophenyl)methyl]morpholine,
ACMC-209bvy,
CTK8B0257,
DTXSID70718443,
ANW-19676,
MFCD20441936,
ZINC74937918,
TC-108421,
Z9803,
K-4253,
C11H13BrFNO,
|
| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 273.016g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.133g/mol |
| Monoisotopic Mass | 273.016g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number