1698-54-0 (6-羟基-2-苯基(2H)-哒嗪-3-酮,6-Hydroxy-2-phenylpyridazin-3(2H)-one)

CAS号:
1698-54-0
中文名称:
6-羟基-2-苯基(2H)-哒嗪-3-酮
英文名称:
6-Hydroxy-2-phenylpyridazin-3(2H)-one
分子式:
C10H8N2O2
分子量:
188.182722091675

6-羟基-2-苯基(2H)-哒嗪-3-酮(1698-54-0)名称与标识符

名称

中文别名:
2-甲基-2-丁硫醇;6-羟基-2-苯基-3-哒嗪酮;6-羟基-2-苯基-3-哒酮;2-苯基-6-羟基-3-哒嗪酮;6-羟基-2-苯基(2H)-哒嗪-3-酮;1,2-二氢-1-苯基-3,6-哒嗪二酮;1-苯基-1,2-二氢哒嗪-3,6-二酮;
英文别名:
6-Hydroxy-2-phenylpyridazin-3(2H)-one;1,2-dihydro-1-phenyl-3,6-Pyridazinedione;2-phenyl-1H-pyridazine-3,6-dione;2-PHENYL-6-HYDROXY-3-PYRIDAZONE;3,6-Pyridazinedione,1,2-dihydro-1-phenyl-;3-HYDROXY-1-PHENYL-6-PYRIDAZONE;1-Phenyl-1,2-dihydro-pyridazin-3,6-dion;1-phenyl-1,2-dihydropyridazine-3,6-dione;2-phenyl-1,2-dihydro-3,6-pyridazinedione;2-Phenyl-3.6-dioxo-1.2.3.6-tetrahydro-pyridazin;6-hydroxy-2-phenyl-2-hydropyridazin-3-one;6-Hydroxy-2-phenyl-3(2H)-pyridazinone;N-Phenyl-maleinsaeure-hydrazid;2-Phenyl-6-hydroxy-3(2H)-pyridazinone;Maleic acid phenylhydrazide;NSC 163341;NSC 17181;Phenyl maleic hydrazide;BUTTPARK 41\07-18;N-Phenyl Maleic Acid Hydrazine;2-phenyl-1H-pyridazine-3,6-quinone;6-Hydroxy-2-Phenyl-3(2H)-Pyridaxinone;PhenylMaleicHydrazide;E4SVY3FH68;HMS2794O23;AC-907/34127062;CS-0314241;6-hydroxy-2-phenyl-2,3-dihydropyridazin-3-one;A882071;AKOS006283059;DTXSID20168752;CHEBI:38885;NSC17181;6-hydroxy-2-phenylpyridazin-3-one;NCGC00246366-01;NS00025569;NSC-163341;UNII-E4SVY3FH68;1,2-Dihydro-1-phenylpyridazine-3,6-dione;Q27118014;SMR000426809;BAA69854;6-HYDROXY-2-PHENYLPYRIDAZIN-3(2H)-ONE;1-PHENYL-1,2-DIHYDROPYRIDAZINE-3,6-DIONE;NCI60_001235;1698-54-0;SCHEMBL265945;CHEMBL1584227;NSC163341;Maybridge4_000324;MLS001029859;AKOS005606784;3,6-Pyridazinedione, 1,2-dihydro-1-phenyl-;EINECS 216-918-1;1-Phenyl-1,2-dihydro-pyridazine-3,6-dione;1-Phenyl-1,2-dihydro-3,6-pyridazinedione;3,4-Dichlorophenylaceticacidmethylester;MFCD00010107;HMS1521O18;IDI1_030906;NSC-17181;2R-1011;KJEBAQNNTMWJJI-UHFFFAOYSA-N;F10221;STK699849;

标识符

MDL:
MFCD00010107
InChIKey:
KJEBAQNNTMWJJI-UHFFFAOYSA-N
Inchi:
1S/C10H8N2O2/c13-9-6-7-10(14)12(11-9)8-4-2-1-3-5-8/h1-7H,(H,11,13)
SMILES:
O=C1C=CC(NN1C1C=CC=CC=1)=O

6-羟基-2-苯基(2H)-哒嗪-3-酮(1698-54-0)物化性质

实验特性

  • LogP : 0.93810
  • PSA : 55.12000

计算特性

  • 精确分子量 : 188.05900
  • 氢键供体数量 : 1
  • 氢键受体数量 : 4
  • 可旋转化学键数量 : 1
  • 同位素质量 : 188.058577502g/mol
  • 重原子数量 : 14
  • 复杂度 : 280
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 0.8
  • 互变异构体数量 : 2
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 49.4Ų

6-羟基-2-苯基(2H)-哒嗪-3-酮(1698-54-0)海关数据

海关编码:
2933990090
海关数据:

中国海关编码:

2933990090

概述:

2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素:

品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期

Summary:

2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%