| CAS Number | 942474-45-5 |
| Catalog Number | AG00II07(AGN-PC-0WNL7D) |
| Chemical Name | 4-Methanesulfonyl-3-(morpholin-4-yl)aniline |
| IUPAC Name | 4-methylsulfonyl-3-morpholin-4-ylaniline |
| InChI | InChI=1S/C11H16N2O3S/c1-17(14,15)11-3-2-9(12)8-10(11)13-4-6-16-7-5-13/h2-3,8H,4-7,12H2,1H3 |
| InChI Key | QBRJRTMDHUKPIL-UHFFFAOYSA-N |
| MDL Number | MFCD09027709 |
| Molecular Formula | C11H16N2O3S |
| Molecular Weight | 256.3213 |
| SMILES | S(C)(C1C=CC(=CC=1N1CCOCC1)N)(=O)=O |
| Synonyms | 942474-45-5,
3-(Morpholin-4-yl)-4-(methylsulfonyl)aniline,
3-morpholin-4-yl-4-(methylsulphonyl)aniline,
4-methanesulfonyl-3-(morpholin-4-yl)aniline,
4-(Methylsulfonyl)-3-morpholinoaniline,
SCHEMBL519730,
CTK7D6811,
QBRJRTMDHUKPIL-UHFFFAOYSA-N,
ZX-AT021689,
MFCD09027709,
OR7870,
ZINC15443071,
AKOS015855905,
TR-048389,
4-Methanesulfonyl-3-morpholin-4-yl-phenylamine,
4-[5-Amino-2-(methylsulphonyl)phenyl]morpholine,
|
| Complexity | 346 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 256.088g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.32g/mol |
| Monoisotopic Mass | 256.088g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 81A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number