3-METHYL-4-(3-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-1-YL)BENZENESULFONIC ACID

CAS No.
118-07-0
CCD No.
CCD00029438
Formula
C11 H12 N2 O4 S
MolWeight
268.292

Basic Information

Product Name: 3-METHYL-4-(3-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-1-YL)BENZENESULFONIC ACID
CAS: 118-07-0
English Synonyms: BENZENESULFONIC ACID, 4-(4,5-DIHYDRO-3-METHYL-5-OXO-1H-PYRAZOL-1-YL)-3-METHYL- ; 6-(4,5-DIHYDRO-3-METHYL-5-OXO-1H-PYRAZOL-1-YL)TOLUENE-3-SULPHONIC ACID ; 3-METHYL-4-(3-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-1-YL)BENZENESULFONIC ACID ; 1-(2-METHYL-4-SULFOPHENYL)-3-METHYL-5-PYRAZOLONE
MDL Number.: MFCD00044051
H bond acceptor: 6
H bond donor: 1
Smile: Cc1cc(ccc1N2C(=O)CC(=N2)C)S(=O)(=O)O
InChi: InChI=1S/C11H12N2O4S/c1-7-5-9(18(15,16)17)3-4-10(7)13-11(14)6-8(2)12-13/h3-5H,6H2,1-2H3,(H,15,16,17)
InChiKey: InChIKey=AJPUJTAMBSRTEG-UHFFFAOYSA-N

Property

Comments: WARNINGS: IRRITANT

Safety information

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