二安替比林甲烷 | 1251-85-0
中文名称:
二安替比林甲烷
英文名称:
4,4'-Methylenebis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)
CAS No.:
1251-85-0
分子式:
C2 3 H2 4 N4 O2
分子量:
388.46226
名称和标识符
MDL
MFCD00149122
InChIKey
OSBQFBKEVMIGTJ-UHFFFAOYSA-N
Inchi
1S/C23H24N4O2/c1-16-20(22(28)26(24(16)3)18-11-7-5-8-12-18)15-21-17(2)25(4)27(23(21)29)19-13-9-6-10-14-19/h5-14H,15H2,1-4H3
SMILES
CC1=C(CC2=C(C)N(C)N(C3=CC=CC=C3)C2=O)C(=O)N(C4=CC=CC=C4)N1C
别名信息
- 中文别名 -
二安替比林甲烷
二安替吡啉甲烷
4,4'-二安替比林甲烷一水合物[用于钛分析]
3-(Cbz-氨基)吡啶-5-硼酸频哪醇酯
4,4'-Diantipyrylmethane Monohydrate[for Ti Analysis] 4,4'-二安替比林甲烷一水合物[用于钛分析]
4,4-二安替比尔甲烷单水合物
二安替比林甲烷,AR
二安替比林甲烷,GR
二氨基吡啉甲烷
1,1’-二安替比林甲烷, 4,4’-次甲基二安替比林甲烷,二(1-苯基-2,3-二甲基-5-吡唑酮)甲烷
1,1'-二安替比林甲烷
2,2-二甲基丁烷
4,4’-次甲基二安替比林甲烷
4,4′-亚甲基二安替比林
4,4'-二安替吡啉甲烷,氢氧化物
4,4'-亚甲基二安替比林
4,4'-亚甲基双(1,2-二氢-1,5-二甲基-2-苯基)-3H-吡唑啉-3-酮
二(1-苯基-2,3-二甲基-5-比唑酮)甲烷
二安替比林甲烷,Diantipyryl methane,AR
二安替吡啉甲烷,Diantipyryl methane,AR
二(1-苯基-2,3-二甲基-5-吡唑酮)甲烷 一水合物
二安替比林甲烷 一水合物
1,1'-二安替比林甲烷 一水合物
4,4'-亚甲基双(1,2-二氢-1,5-二甲基-2-苯基)-3H-吡唑啉-3-酮 一水合物
4,4'-亚甲基双(1,2-二氢-1,5-二甲基-2-苯基)-3H-吡唑啉-3-酮水合物[用于钛分析] 一水合物
4,4'-次甲基二安替比林甲烷 一水合物
二安替比林基甲烷
- 英文别名 -
4,4'-Methylenebis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)
4,4-Methylenediantipyrine
Trichachnine monohydrate
Diantipyrylmethane
4,4'-Diantipyrylmethane Monohydrate[for Ti Analysis]
4,4′-Methylenediantipyrine
DI-ANTIPYRINEMETHANE
2,2-DiMethylbutane
4,4′-Methylene-bis(1,2-dihydro-1,5-diMethyl-2-phenyl-3H-pyrazol-3-one)
4,4'-Diantipyrylmethane Hydrate [for Ti Analysis]
4,4'-Diantipyrylmethane Monohydrate
4,4'-Methylenebis(1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one)
4,4'-Methylenediantipyrine monohydrate
4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one
Di(1-Phenyl-2,3-diMethylpyrazolon-5-yl) Methane
Di-(1-phenyl-2,3-dimethylpyrazolon-5-yl)methane
Trichachnine
4,4'-methylenebis(1,2-dihydro-1,5-dimethyl-2-phenyl)-3H-Pyrazol-3-one
4,4'-Methylenediantipyrine
Diantipyrinylmethane
NSC 60670
4,4'-Methylenediantipyrine Monohydrate
AKOS000361498
EN300-19746
3H-Pyrazol-3-one,4,4'-methylenebis[1,2-dihydro-1,5-dimethyl-2-phenyl-
D1029
4-4'-Diantipyrylmethane
4,4 Diantipyrylmethane monohydrate
Z104475040
ChemDiv2_001377
NCGC00246258-01
4,4'-Diantipyrylmethane
4,4-Diantipyrylmethane Monohydrate
W-108404
4,4'-Methylenebis[1,5-dimethyl-2-phenyl-3-pyrazolone
4,4'-Diantipyrylmethane Monohydrate [for Ti Analysis]
3H-Pyrazol-3-one, 4,4'-methylenebis*1,2-dihydro-1,5-dimethyl-2-phenyl-
HMS2584J09
4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one
3H-Pyrazol-3-one, 4,4'-methylenebis[1,2-dihydro-1,5-dimethyl-2-phenyl-
SY057040
MLS000554200
CCG-21478
BAA25185
E75799
Bisantipyrylmethane
4,4'-Methylenebis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)...
NS00024025
AMY22518
C23H24N4O2
SMR000146517
SCHEMBL3879841
Diantipyryl methane
Antipyrine, 4,4'-methylenedi-
NSC-60670
Oprea1_189735
HMS1372M13
CHEMBL85233
3H-Pyrazol-3-one,4'-methylenebis[1,2-dihydro-1,5-dimethyl-2-phenyl-
1251-85-0
EU-0079791
EINECS 215-009-7
DTXSID2061640
4-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)methyl]-1,5-dimethyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one
CS-W009738
NSC60670
4-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)methyl]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
MFCD00003147
Antipyrine,4'-methylenedi-
Diantipyrylmethan
QATHNKNPUVVKHK-UHFFFAOYSA-N
BRD-K06968280-001-07-3
3H-Pyrazol-3-one, 4,4'-methylenebis(1,2-dihydro-1,5-dimethyl-2-phenyl-
trichachnine
AF-407/31882031
FT-0624620
物化性质
实验特性
LogP
2.87300
PSA
53.86000
折射率
1.6500 (estimate)
沸点
514.17°C (rough estimate)
熔点
156 °C (dec.) (lit.)
闪点
212.5°C
溶解度
微溶 (2.2 g/L) (25 ºC),
颜色与性状
白色片状结晶
稳定性
Stable. Incompatible with strong oxidizing agents.
溶解性
不溶于水、醚和碱,溶于酸、乙醇和三氯甲烷
密度
1.232±0.06 g/cm3 (20 ºC 760 Torr),
计算特性
精确分子量
388.19000
氢键供体数量
0
氢键受体数量
6
可旋转化学键数量
4
同位素质量
388.19
重原子数量
29
复杂度
682
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)
4
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
47.1A^2
海关数据
海关编码
2942000000
海关数据
中国海关编码:
2942000000
相关文献
1.
Determination of titanium(IV) in river water by ion-pair reversed-phase high-performance liquid chromatography with 4,4′-diantipyrylmethane
Nobuo Uehara,Kazuhiro Morimoto,Yoshio Shijo Analyst 1991 116 27
2.
Spectrophotometric determination of dissolved titanium in sea water after sodium diethyldithiocarbamate pre-concentration
C. Y. Yang,J. S. Shih,Y. C. Yeh Analyst 1981 106 385
3.
The spectrophotometric determination of titanium in iron and steel with diantipyrylmethane
J. A. Corbett Analyst 1968 93 383
4.
Photometric determination of titanium in ores, rocks and minerals with diantipyrylmethane
P. G. Jeffery,G. R. E. C. Gregory Analyst 1965 90 177
5.
Flow injection analysis of silicate rocks for titanium
Tadashi Mochizuki,Rokuro Kuroda Analyst 1982 107 1255
6.
Index pages
Analyst 1991 116 A001
7.
Index pages
Analyst 1965 90 A001
8.
Index pages
Analyst 1968 93 A001
9.
Prediction of toluene/water partition coefficients in the SAMPL9 blind challenge: assessment of machine learning and IEF-PCM/MST continuum solvation models
William J. Zamora,Antonio Viayna,Silvana Pinheiro,Carles Curutchet,Laia Bisbal,Rebeca Ruiz,Clara Ràfols,F. Javier Luque Phys. Chem. Chem. Phys. 2023 25 17952
10.
The influence of fluoride ions on the equilibrium between titanium ions and titanium metal in fused alkali chloride melts
Jianxun Song,Qiuyu Wang,Jinyu Wu,Shuqiang Jiao,Hongmin Zhu Faraday Discuss. 2016 190 421
参考资料
Reaxys RN
59702
Beilstein
26,489
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