1240287-96-0
1-((3-bromo-4-methylphenyl)sulfonyl)-4-methylpiperazine
Name1-((3-bromo-4-methylphenyl)sulfonyl)-4-methylpiperazine
1Identification
【Name】
1-((3-bromo-4-methylphenyl)sulfonyl)-4-methylpiperazine
【CAS】
【MDL】
【English Synonyms】
【Formula】
C12H17BrN2O2S
【MolWeight】
333.245
【Inchi】
InChI=1S/C12H17BrN2O2S/c1-10-3-4-11(9-12(10)13)18(16,17)15-7-5-14(2)6-8-15/h3-4,9H,5-8H2,1-2H3
【InChIKey】
InChIKey=CZHPEAVUYXCWAN-UHFFFAOYSA-N
【SMILES】
BrC=1C=C(C=CC1C)S(=O)(=O)N1CCN(CC1)C
【MOL File】
1-((3-bromo-4-methyl….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
1-((3-bromo-4-methylphenyl)sulfonyl)-4-methylpiperazine.cml