| CAS Number | 874754-28-6 |
| Catalog Number | AG00GUFW |
| Chemical Name | 4-((4-(2-Bromoethoxy)phenyl)sulfonyl)morpholine |
| IUPAC Name | 4-[4-(2-bromoethoxy)phenyl]sulfonylmorpholine |
| InChI | InChI=1S/C12H16BrNO4S/c13-5-8-18-11-1-3-12(4-2-11)19(15,16)14-6-9-17-10-7-14/h1-4H,5-10H2 |
| InChI Key | RNGPYGSMWJMZME-UHFFFAOYSA-N |
| MDL Number | MFCD07689463 |
| Molecular Formula | C12H16BrNO4S |
| Molecular Weight | 350.2287 |
| SMILES | BrCCOC1=CC=C(C=C1)S(=O)(=O)N1CCOCC1 |
| Synonyms | 4-{[4-(2-bromoethoxy)phenyl]sulfonyl}morpholine,
874754-28-6,
4-[4-(2-bromoethoxy)benzenesulfonyl]morpholine,
4-[[4-(2-bromoethoxy)phenyl]sulfonyl]morpholine,
4-((4-(2-Bromoethoxy)phenyl)sulfonyl)morpholine,
AC1OFLRR,
AC1Q27ZY,
CTK5J0403,
ZINC4218916,
AKOS000118149,
MCULE-9617828147,
NE24205,
EN300-15374,
4-[4-(2-bromoethoxy)phenyl]sulfonylmorpholine,
4-{[4-(2-bromoethoxy)benzene]sulfonyl}morpholine,
J-514265,
ZINC04218916,
CID7131580,
|
| Complexity | 356 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 348.998g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 350.227g/mol |
| Monoisotopic Mass | 348.998g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 64.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number