| CAS Number | 325855-09-2 |
| Catalog Number | AG019YW7 |
| Chemical Name | 4-[4-(Morpholine-4-sulfonyl)-2-nitrophenyl]morpholine |
| IUPAC Name | 4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)morpholine |
| InChI | InChI=1S/C14H19N3O6S/c18-17(19)14-11-12(24(20,21)16-5-9-23-10-6-16)1-2-13(14)15-3-7-22-8-4-15/h1-2,11H,3-10H2 |
| InChI Key | ZUSHGIMCLKVKEA-UHFFFAOYSA-N |
| MDL Number | MFCD00206503 |
| Molecular Formula | C14H19N3O6S |
| Molecular Weight | 357.3822 |
| SMILES | [O-][N+](C1=C(N2CCOCC2)C=CC(S(N2CCOCC2)(=O)=O)=C1)=O |
| Synonyms | 4-[4-(morpholine-4-sulfonyl)-2-nitrophenyl]morpholine,
325855-09-2,
AC1MDY1W,
ZINC4344496,
AKOS003630184,
CCG-253973,
MCULE-9069557480,
NE18963,
4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)morpholine,
Z31211424,
ZINC04344496,
CID2818602,
|
| Complexity | 534 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 357.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 357.381g/mol |
| Monoisotopic Mass | 357.099g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 113A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number