| CAS Number | 168828-76-0 |
| Catalog Number | AG01DYT5(AGN-PC-03H31T) |
| Chemical Name | 3,5-Difluoro-4-(morpholin-4-yl)aniline |
| IUPAC Name | 3,5-difluoro-4-morpholin-4-ylaniline |
| InChI | InChI=1S/C10H12F2N2O/c11-8-5-7(13)6-9(12)10(8)14-1-3-15-4-2-14/h5-6H,1-4,13H2 |
| InChI Key | YSZMSIBWWSWHEB-UHFFFAOYSA-N |
| MDL Number | MFCD12778441 |
| Molecular Formula | C10H12F2N2O |
| Molecular Weight | 214.2119 |
| SMILES | NC1=CC(F)=C(N2CCOCC2)C(F)=C1 |
| Synonyms | 3,5-Difluoro-4-(morpholin-4-yl)aniline,
168828-76-0,
Benzenamine, 3,5-difluoro-4-(4-morpholinyl)-,
SCHEMBL1354385,
3,5-difluoro-4-morpholinoaniline,
YSZMSIBWWSWHEB-UHFFFAOYSA-N,
3,5-difluoro-4-morpholinyl-aniline,
AKOS010244163,
3,5-difluoro-4-(4-morpholinyl)aniline,
3,5-Difluoro-4-morpholin-4-yl-phenylamine,
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| Complexity | 200 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.216g/mol |
| Monoisotopic Mass | 214.092g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number