| CAS Number | 1338977-90-4 |
| Catalog Number | AG01AD6P(AGN-PC-0WO6WH) |
| Chemical Name | 2-(3-bromo-4-fluorophenyl)morpholine |
| IUPAC Name | 2-(3-bromo-4-fluorophenyl)morpholine |
| InChI | InChI=1S/C10H11BrFNO/c11-8-5-7(1-2-9(8)12)10-6-13-3-4-14-10/h1-2,5,10,13H,3-4,6H2 |
| InChI Key | PHFYBLLSWCVDOJ-UHFFFAOYSA-N |
| MDL Number | MFCD17246947 |
| Molecular Formula | C10H11BrFNO |
| Molecular Weight | 260.1028 |
| SMILES | FC1=C(Br)C=C(C2OCCNC2)C=C1 |
| Synonyms | 2-(3-bromo-4-fluorophenyl)morpholine,
1338977-90-4,
AKOS012210186,
NE16196,
Z2256088863,
|
| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.106g/mol |
| Monoisotopic Mass | 259.001g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number