| CAS Number | 736948-98-4 |
| Catalog Number | AG019IXE |
| Chemical Name | 2-Ethoxy-5-(morpholine-4-sulfonyl)aniline |
| IUPAC Name | 2-ethoxy-5-morpholin-4-ylsulfonylaniline |
| InChI | InChI=1S/C12H18N2O4S/c1-2-18-12-4-3-10(9-11(12)13)19(15,16)14-5-7-17-8-6-14/h3-4,9H,2,5-8,13H2,1H3 |
| InChI Key | KXULWZPHEQZNOZ-UHFFFAOYSA-N |
| MDL Number | MFCD04638770 |
| Molecular Formula | C12H18N2O4S |
| Molecular Weight | 286.3473 |
| SMILES | CCOC1=C(N)C=C(S(N2CCOCC2)(=O)=O)C=C1 |
| Synonyms | 2-ethoxy-5-(morpholine-4-sulfonyl)aniline,
2-ethoxy-5-(morpholin-4-ylsulfonyl)aniline,
736948-98-4,
AC1NMOB1,
AC1Q37GP,
CTK6G2456,
ZINC3887174,
AKOS008967040,
MCULE-9330421924,
NE12993,
2-ethoxy-5-morpholin-4-ylsulfonylaniline,
EN300-07960,
SR-01000049686,
SR-01000049686-1,
Z56963403,
ZINC03887174,
CID5013290,
|
| Complexity | 376 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 286.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 286.346g/mol |
| Monoisotopic Mass | 286.099g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 90.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number