790271-04-4
3-[(2-METHYLPROPYL)SULFAMOYL]BENZOIC ACID
Name3-[(2-METHYLPROPYL)SULFAMOYL]BENZOIC ACID
1Identification
【Name】
3-[(2-METHYLPROPYL)SULFAMOYL]BENZOIC ACID
【CAS】
【MDL】
MFCD06357870
【English Synonyms】
【Formula】
C11 H15 N O4 S
【MolWeight】
257.309
【Inchi】
InChI=1S/C11H15NO4S/c1-8(2)7-12-17(15,16)10-5-3-4-9(6-10)11(13)14/h3-6,8,12H,7H2,1-2H3,(H,13,14)
【InChIKey】
InChIKey=GJTAKJCYTBUBKE-UHFFFAOYSA-N
【SMILES】
CC(C)CNS(=O)(=O)c1cccc(c1)C(=O)O
【MOL File】
3-[(2-METHYLPROPYL)S….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
3-[(2-METHYLPROPYL)SULFAMOYL]BENZOIC ACID.cml