4-苯氧基吡啶 | 4783-86-2
中文名称:
4-苯氧基吡啶
英文名称:
4-Phenoxypyridine
CAS No.:
4783-86-2
分子式:
C1 1 H9 NO
分子量:
171.1953
名称和标识符
MDL
MFCD00235157
InChIKey
OATKXQIGHQXTDO-UHFFFAOYSA-N
Inchi
1S/C11H9NO/c1-2-4-10(5-3-1)13-11-6-8-12-9-7-11/h1-9H
SMILES
O(C1C([H])=C([H])N=C([H])C=1[H])C1C([H])=C([H])C([H])=C([H])C=1[H]
别名信息
- 中文别名 -
4-苯氧基吡啶
4-Phenoxypyridine 4-苯氧基吡啶
4-苯氧吡啶
串珠镰刀菌素钾盐
苯基(4-吡啶基)醚
- 英文别名 -
4-Phenoxypyridine
4-Phenoxy-pyridin
4-Phenoxy-pyridine
Pyridine,4-phenoxy
NSC 68195
Pyridine, 4-phenoxy-
4-Phenoxy pyridine
NSC68195
KSC236C3F
4-Phenoxypyridine, AldrichCPR
OATKXQIGHQXTDO-UHFFFAOYSA-N
SBB088506
FCH917719
FC0334
STK366341
VP13757
TRA0009525
Q273
TC
P1413
FT-0646251
AM20061245
AC-7566
MFCD00235157
A7305
NSC-68195
SCHEMBL1680381
DS-1102
AKOS005203379
FS-3151
4783-86-2
CS-W017655
A827359
SY030461
CHEMBL119600
DTXSID00290343
4-phenoxypyridine
SB52358
物化性质
实验特性
LogP
2.87390
PSA
22.12000
沸点
274.4°C at 760 mmHg
熔点
44.0 to 48.0 deg-C
颜色与性状
White to Yellow Solid
溶解性
不确定
计算特性
精确分子量
171.06800
氢键供体数量
0
氢键受体数量
2
可旋转化学键数量
2
同位素质量
171.068413911g/mol
重原子数量
13
复杂度
137
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)
2.4
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
22.1
海关数据
海关编码
2933399090
海关数据
中国海关编码:
2933399090
概述:
2933399090. 其他结构含非稠合吡啶环的化合物. 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:
2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
生产方法和用途
方法
用吡啶与氯化亚硫酰反应,生成N-(4-吡啶基)吡啶盐酸盐,然后与苯酚反应制得该品。
用途
抗菌剂奥替尼丁的中间体。
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Synthesis of C
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Alan C. Spivey,Adrian Maddaford,Tomasz Fekner,Alison J. Redgrave,Christopher S. Frampton 2-symmetric analogues of 4-(pyrrolidino)pyridine: new chiral nucleophilic catalysts. Alan C. Spivey Adrian Maddaford Tomasz Fekner Alison J. Redgrave Christopher S. Frampton J. Chem. Soc. Perkin Trans. 1 2000 3460
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参考资料
Reaxys RN
120480
Beilstein
21(5)2,101
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