1-(4'-磺酸苯基)-3-羧基-5-吡唑啉酮

CAS号
118-47-8
CCD编号
CCD00017612
分子式
C10 H8 N2 O6 S
分子量
284.247

基本信息

产品名称: 1-(4'-磺酸苯基)-3-羧基-5-吡唑啉酮
CAS: 118-47-8
中文同义词: 5-氧代-1-(4-磺苯基)-2-吡唑林-3-羧酸 ; 1-(4'-磺酸苯基)-3-羧基-5-吡唑啉酮
英文同义词: PYRAZOLONE T ; 1-(4'-SULFOPHENYL)-3-CARBOXY-5-PYRAZOLONE ; 5-OXO-1-(P-SULFOPHENYL)-2-PYRAZOLINE-3-CARBOXYLIC ACID ; 5-OXO-1-(4-SULFOPHENYL)-4,5-DIHYDRO-1H-PYRAZOLE-3-CARBOXYLIC ACID ; 1H-PYRAZOLE-3-CARBOXYLIC ACID, 4,5-DIHYDRO-5-OXO-1-(4-SULFOPHENYL)- ; 1-(4-SULFOPHENYL)-3-CARBOXY-5-PYRAZOLONE ; 1-(P-SULFOPHENYL)-5-PYRAZOLONE-3-CARBOXYLIC ACID ; CARBOXYPYRAZOLIC ACID ; 4,5-DIHYDRO-5-OXO-1-(4-SULFOPHENYL)-1H-PYRAZOLE-3-CARBOXYLIC ACID ; 5-OXO-1-(4-SULFOPHENYL)-2-PYRAZOLINE-3-CARBOXYLIC ACID
MDL号: MFCD00020755
氢键受体数量: 8
氢键供体数量: 2
Smile: c1cc(ccc1N2C(=O)CC(=N2)C(=O)O)S(=O)(=O)O
InChi: InChI=1S/C10H8N2O6S/c13-9-5-8(10(14)15)11-12(9)6-1-3-7(4-2-6)19(16,17)18/h1-4H,5H2,(H,14,15)(H,16,17,18)
InChiKey: InChIKey=TYCNXOAPQGVAQU-UHFFFAOYSA-N

性质

注解: WARNINGS: IRRITANT

安全信息

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