58760-59-1
2-BROMO-1-[4-(MORPHOLIN-4-YLSULFONYL)PHENYL]ETHANONE
Name2-BROMO-1-[4-(MORPHOLIN-4-YLSULFONYL)PHENYL]ETHANONE
1Identification
【Name】
2-BROMO-1-[4-(MORPHOLIN-4-YLSULFONYL)PHENYL]ETHANONE
【CAS】
【MDL】
MFCD06373453
【English Synonyms】
【Formula】
C12 H14 Br N O4 S
【MolWeight】
348.216
【Inchi】
InChI=1S/C12H14BrNO4S/c13-9-12(15)10-1-3-11(4-2-10)19(16,17)14-5-7-18-8-6-14/h1-4H,5-9H2
【InChIKey】
InChIKey=AOXMRCRZFSYCQD-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1C(=O)CBr)S(=O)(=O)N2CCOCC2
【MOL File】
2-BROMO-1-[4-(MORPHO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-BROMO-1-[4-(MORPHOLIN-4-YLSULFONYL)PHENYL]ETHANONE.cml