4-甲氧基肉桂醛 | 24680-50-0
4-甲氧基肉桂醛
trans-p-Methoxycinnamaldehyde
24680-50-0
C10H10O2
162.1852
名称和标识符
MDL |
MFCD00017343 |
InChIKey |
AXCXHFKZHDEKTP-NSCUHMNNSA-N |
Inchi |
1S/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-8H,1H3/b3-2+ |
SMILES |
O(C([H])([H])[H])C1C([H])=C([H])C(/C(/[H])=C(\[H])/C([H])=O)=C([H])C=1[H] |
BRN |
1447540 |
别名信息
- 中文别名 -
- 4-甲氧基肉桂醛
- 4-甲氧基肉桂醛, 主要为反式
- 反-4-甲氧基丙烯酸酯
- 反-4-甲氧基肉桂醛
- 反式4-甲氧基肉桂醛
- (E)-3-(4-甲氧基苯基)丙烯醛
- (E)-3-(4-甲氧基苯基)-2-丙烯醛
- 英文别名 -
- trans-4-Methoxycinnamaldehyde
- trans-p-Methoxycinnamaldehyde
- (E)-4-Methoxycinnamaldehyde
- 4-METHOXYCINNAMALDEHYDE
- trans-p-Methoxycinna
- 3-p-methoxyphenyl-2-propenal
- PARA-METHOXY CINNAMIC ALDEHYDE
- para-methoxycinnamaldehyde
- P-METHOXY CINNAMIC ALDEHYDE
- (E)-3-(4-Methoxyphenyl)acrylaldehyde
- (E)-3-(4-Methoxyphenyl)-2-propenal
- 3-(4-methoxyphenyl)acrylaldehyde
- p-Methoxycinnamaldehyde
- p-Methoxycinnamic aldehyde
- 3-(4-Methoxyphenyl)-2-propenal
- p-Methoxy cinnamaldehyde
- Cinnamaldehyde, p-methoxy-
- 2-propenal, 3-(4-methoxyphenyl)-, (2E)-
- Methoxycinnamaldehyde, p-
- (2E)-3-(4-methoxyphenyl)acrylaldehyde
- para-Methoxy cinnam
物化性质
实验特性
LogP |
1.90730 |
PSA |
26.30000 |
折射率 |
1.6000 (estimate) |
水溶性 |
Insoluble in water. |
沸点 |
176°C/14mmHg(lit.) |
熔点 |
57.0 to 61.0 deg-C |
闪点 |
160°C/3mm |
颜色与性状 |
无可用 |
溶解性 |
无可用 |
敏感性 |
Air Sensitive |
密度 |
1.0281 (rough estimate) |
计算特性
精确分子量 |
162.06800 |
氢键供体数量 |
0 |
氢键受体数量 |
2 |
可旋转化学键数量 |
3 |
同位素质量 |
162.06808 |
重原子数量 |
12 |
复杂度 |
155 |
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 |
1 |
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) |
1.8 |
表面电荷 |
0 |
拓扑分子极性表面积 |
26.3 |
相关文献
-
1.
Modular synthesis of (E)-cinnamaldehydes directly from allylarenes via a metal-free DDQ-mediated oxidative process
Ting-Ting Xu,Tao-Shan Jiang,Xiao-Lan Han,Yuan-Hong Xu,Jin-Ping Qiao Org. Biomol. Chem. 2018 16 5350
-
2.
Transition metal-free reductive coupling of allylic sulfonylhydrazones with aryl boronic acids for C(sp3)–C(sp2) bond formation
Kasim Ali,Gurudayal Prajapati,Ravi Sankar Ampapathi,Gautam Panda Org. Biomol. Chem. 2022 20 8672
-
3.
Copper-catalyzed oxidative amidation of α,β-unsaturated ketones via selective C–H or C–C bond cleavage
Tony Wheellyam Pouambeka,Ge Zhang,Guang-Fan Zheng,Guo-Xing Xu,Qian Zhang,Tao Xiong,Qian Zhang Org. Chem. Front. 2017 4 1420
-
4.
4-[4-(4-Methoxyphenyl)-1,3-butadienyl]-1-methylpyridinium 4-chlorobenzene sulphonate (MBMPCBS) – an efficient nonlinear optical crystal with superior thermal stability
Anand Arul,Jerald Vijay Ramaclus CrystEngComm 2023 25 2534
-
5.
Enantioselective annulation of enals with 2-naphthols by triazolium salts derived from l-phenylalanine
Guo-Tai Li,Qing Gu,Shu-Li You Chem. Sci. 2015 6 4273
-
6.
Expanding the toolbox of asymmetric organocatalysis by continuous-flow process
Fernanda G. Finelli,Leandro S. M. Miranda,Rodrigo O. M. A. de Souza Chem. Commun. 2015 51 3708
-
7.
NH2-MIL-125(Ti)-derived porous cages of titanium oxides to support Pt–Co alloys for chemoselective hydrogenation reactions
Zhizhi Gu,Liyong Chen,Xuezhao Li,Lin Chen,Yingyue Zhang,Chunying Duan Chem. Sci. 2019 10 2111
-
8.
Highly efficient aqueous phase chemoselective hydrogenation of α,β-unsaturated aldehydes catalysed by phosphine-decorated polymer immobilized IL-stabilized PdNPs
S. Doherty,J. G. Knight,T. Backhouse,E. Abood,H. Alshaikh,I. J. S. Fairlamb,R. A. Bourne,T. W. Chamberlain,R. Stones Green Chem. 2017 19 1635
-
9.
Oxidative N-heterocyclic carbene-catalyzed [3 + 3] annulation reaction of enals with benzofuran-3-ones: efficient access to benzofuran-fused δ-lactones
Zhan-Yong Wang,Ting Yang,Kai-Kai Wang,Rongxiang Chen,Menghan Liu,Hongxin Liu Org. Chem. Front. 2020 7 1011
-
10.
Nonlinear optical properties of diaromatic stilbene, butadiene and thiophene derivatives
Esa Kukkonen,Elmeri Lahtinen,Pasi Myllyperki?,Matti Haukka,Jari Konu New J. Chem. 2021 45 6640
参考资料
Reaxys RN |
1861539 |
Beilstein |
MFCD00017343 |
下游
对甲氧基苯乙酮
1-甲氧-4丙基苯
对溴苯甲醚
对甲氧基苄醇
烯丙基溴
丙烯醛
乙酸乙烯酯
三乙胺
对羟基苯甲醛
对羟基苯甲醛
对羟基苯甲醛
4-甲氧基苯甲醛
双(三甲基甲硅烷基)-N-叔-丁基乙酰醛亚胺
4-甲氧基苯基溴化镁
4-烯丙基苯甲醚
Benzenemethanol, 4-methoxy-a-[(trimethylsilyl)ethynyl]-
4-methoxyphenyl-n-methyl nitrone
Methylene, oxo-
3-(4-甲氧基苯基)丙醛
对甲氧基肉桂酸乙酯
2,4,4,6-四甲基-1-氧杂-3-氮杂-2-环己烯
4-甲氧基溴苄
丙烯醛缩二乙醇
4-甲氧基-α-甲基苯甲醇
1-环丙基-4-甲氧基苯
4-甲氧基苯偶氮鎓四氟硼酸盐
(1,3-二氧环戊基-2-甲基)三苯基溴化膦
对甲氧基苯硼酸
1,3-Dioxolane, 2-[(1E)-2-(4-methoxyphenyl)ethenyl]-
对甲氧基苯乙烯
N,N-二甲基甲酰胺
对碘苯甲醚
2-丙胺,N-乙亚基-2-甲基
3,3-Diethoxy-1-(4-methoxyphenyl)-1-propen
苯
3,3-Diethoxy-1-(4-methoxyphenyl)-(E)-1-propen
3-(p-methoxyphenyl)-1-propene-3,3-d2
2-Propenal, 3-(phenylseleno)-, (E)-
碘甲烷
叔丁醇
4-乙炔基苯甲醚
1-(4-methoxyphenyl)-3,3-bis(methylthio)propan-1-one
二氯二氰苯醌
Benzenemethanol, a-[2-ethoxy-1-(phenyltelluro)ethenyl]-4-methoxy-
N-甲基甲酰苯胺
4-甲氧基肉桂酸
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