784172-03-8
2-BROMO-5-(TERT-BUTYLSULFAMOYL)BENZOIC ACID
Name2-BROMO-5-(TERT-BUTYLSULFAMOYL)BENZOIC ACID
1Identification
【Name】
2-BROMO-5-(TERT-BUTYLSULFAMOYL)BENZOIC ACID
【CAS】
【MDL】
MFCD06349001
【English Synonyms】
【Formula】
C11 H14 Br N O4 S
【MolWeight】
336.205
【Inchi】
InChI=1S/C11H14BrNO4S/c1-11(2,3)13-18(16,17)7-4-5-9(12)8(6-7)10(14)15/h4-6,13H,1-3H3,(H,14,15)
【InChIKey】
InChIKey=JNMUBPIQBJDJAF-UHFFFAOYSA-N
【SMILES】
CC(C)(C)NS(=O)(=O)c1ccc(c(c1)C(=O)O)Br
【MOL File】
2-BROMO-5-(TERT-BUTY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-BROMO-5-(TERT-BUTYLSULFAMOYL)BENZOIC ACID.cml