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龙葵醛二甲醇缩醛 | 90-87-9

龙葵醛二甲醇缩醛结构式图片|90-87-9结构式图片
龙葵醛二甲醇缩醛
(1,1-Dimethoxypropan-2-yl)benzene
90-87-9
C11H16O2
180.243543624878
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:龙葵醛二甲醇缩醛结构式
名称和标识符
InChIKey UFOUDYPOSJJEDJ-UHFFFAOYSA-N
Inchi 1S/C11H16O2/c1-9(11(12-2)13-3)10-7-5-4-6-8-10/h4-9,11H,1-3H3
SMILES O(C(C(C)C1C=CC=CC=1)OC)C
别名信息
- 中文别名 -
  • 龙葵醛二甲醇缩醛
  • (2,2-二甲氧基-1-甲基乙基)苯
  • (2,2-二甲氧基-1-甲基乙基)-苯
  • β-苯丙醛二甲缩醛
  • 龙葵醛二甲缩醛
- 英文别名 -
  • (1,1-Dimethoxypropan-2-yl)benzene
  • 2-phenylpropionaldehyde-dimethyl acetal
  • 1,1-dimethoxy-2-phenylpropane
  • 2-phenyloropionaldehyde dimethyl acetal
  • 2-phenylpropionaldehyde dimethyl acetal
  • HYDRATROPIC ALDEHYDE DIMETHYLACETAL, FCC GRADE
  • 1,1-difluoroethyl phenyl ether
  • 1,2-dimethoxy-2-phenyl propane
  • 2-phenylpropanal dimethyl acetal
  • Hydratropic aldehyde dimethyl acetall
  • NSC 46115
  • alpha-Methylphenacetaldehyde dimethyl acetal
  • 2-Phenylpropanal dimethylacetal
  • (2,2-Dimethoxy-1-methylethyl)benzene (ACI)
  • Hydratropaldehyde, dimethyl acetal (6CI, 7CI, 8CI)
  • 1,1-Dimethoxy-2-phenylpropane
  • 2-Phenylpropionaldehyde dimethyl acetal
  • Hydratropic aldehyde dimethyl acetal
  • Hydrotropaldehyde dimethyl acetal
  • α-Methylphenacetaldehyde dimethyl acetal
物化性质
实验特性
LogP 2.40900
PSA 18.46000
折射率 n20/D 1.493(lit.)
沸点 226.4±0.0 ºC (760 Torr),
闪点 92.2±0.0 ºC,
FEMA 2888 | 2-PHENYLPROPIONALDEHYDE DIMETHYL ACETAL
溶解度 微溶 (4 g/L) (25 ºC),
密度 0.971±0.06 g/cm3 (20 ºC 760 Torr),
计算特性
精确分子量 180.11500
氢键供体数量 0
氢键受体数量 2
可旋转化学键数量 4
同位素质量 180.11503
重原子数量 13
复杂度 126
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 1
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
表面电荷 0
拓扑分子极性表面积 18.5
合成路线

合成路线:1 步

反应条件:
参考文献:
Hypoiodous acid-catalyzed regioselective geminal addition of methanol to vinylarenes: synthesis of anti-Markovnikov methyl acetals
Peraka, Swamy; Mameda, Naresh; Marri, Mahender Reddy; Kodumuri, Srujana; Chevella, Durgaiah; et al, RSC Advances, 2015, 5(90), 73732-73736

合成路线:1 步

反应条件:
参考文献:
A new scandium metal organic framework built up from octadecasil zeolitic cages as heterogeneous catalyst
Gandara, Felipe; Gomez-Lor, Berta; Iglesias, Marta; Snejko, Natalia; Gutierrez-Puebla, Enrique; et al, Chemical Communications (Cambridge, 2009, (17), 2393-2395

合成路线:1 步

反应条件:
参考文献:
Two-way homologation of aliphatic aldehydes: Both one-carbon shortening and lengthening via the same intermediate
Yoo, Jae Won; Seo, Youngran; Park, Jong Beom; Kim, Young Gyu, Tetrahedron, 2020, 76(6),

合成路线:1 步

参考文献:
Product class 6: acyclic and semicyclic O/O acetals
von Angerer, S.; Warriner, S. L., Science of Synthesis, 2007, 29, 303-406

合成路线:1 步

反应条件:
参考文献:
Three-step synthesis of 1,1-dimethoxy-2-phenylpropane
Hajek, Jan; Kacer, Petr; Cerveny, Libor, Research on Chemical Intermediates, 2002, 28(6), 551-559

合成路线:1 步

反应条件:
参考文献:
Unexpected catalysis: aprotic pyridinium ions as active and recyclable Bronsted acid catalysts in protic media
Procuranti, Barbara; Connon, Stephen J., Organic Letters, 2008, 10(21), 4935-4938

合成路线:1 步

反应条件:
参考文献:
IPy2BF4-mediated rearrangements of 1,2-difunctionalized compounds and olefins
Fananas, Francisco J.; Alvarez-Perez, Monica; Rodriguez, Felix, Chemistry - A European Journal, 2005, 11(20), 5938-5944

合成路线:1 步

反应条件:
参考文献:
Chiral Germanium Zeotype with Interconnected 8-, 11-, and 11-Ring Channels. Catalytic Properties
Medina, M. E.; Iglesias, M.; Snejko, N.; Gutierrez-Puebla, E.; Monge, M. A., Chemistry of Materials, 2004, 16(4), 594-599

合成路线:1 步

反应条件:
参考文献:
Process and zeolite catalysts for the regioselective acetalization and transacetalization of aldehydes in the manufacture of acetals
, Spain, , ,

合成路线:1 步

反应条件:
参考文献:
SO3H-functionalized silica for acetalization of carbonyl compounds with methanol and tetrahydropyranylation of alcohols
Shimizu, Ken-Ichi; Hayashi, Eidai; Hatamachi, Tsuyoshi; Kodama, Tatsuya; Kitayama, Yoshie, Tetrahedron Letters, 2004, 45(26), 5135-5138

合成路线:1 步

反应条件:
参考文献:
An Indium Layered MOF as Recyclable Lewis Acid Catalyst
Gandara, F.; Gomez-Lor, B.; Gutierrez-Puebla, E.; Iglesias, M.; Monge, M. A.; et al, Chemistry of Materials, 2008, 20(1), 72-76

合成路线:1 步

反应条件:
参考文献:
Rh(I) or Rh(III) supported on MCM-41-catalyzed selective hydroformylation-acetalization of aryl alkenes: Effect of the additives
El Ali, Bassam; Tijani, Jimoh; Fettouhi, Mohammed, Applied Catalysis, 2006, 303(2), 213-220

合成路线:1 步

反应条件:
参考文献:
Highly effective tandem hydroformylation-acetalization of olefins using a long-life Bronsted acid-Rh bifunctional catalyst in ionic liquid-alcohol systems
Jin, Xin; Zhao, Kun; Cui, Feifei; Kong, Fangfang; Liu, Qiangqiang, Green Chemistry, 2013, 15(11), 3236-3242

合成路线:1 步

反应条件:
参考文献:
A simple and efficient conversion of aldehyde acetals into esters
Sugai, Saburo; Kodama, Takashi; Akaboshi, Sanya; Ikegami, Shiro, Chemical & Pharmaceutical Bulletin, 1984, 32(1), 99-105

合成路线:1 步

反应条件:
参考文献:
A generalized approach for iron catalyzed chemo- and regioselective formation of anti-Markovnikov acetals from styrene derivatives
Dutta Chowdhury, Abhishek; Kumar Lahiri, Goutam, Chemical Communications (Cambridge, 2012, 48(28), 3448-3450

合成路线:1 步

参考文献:
Novel delaminated zeolites are more active acid catalysts than conventional zeolites and mesoporous Al/MCM-41 for the synthesis of fine chemicals
Climent, Maria J.; Corma, Avelino; Fomes, Vicente; Garcia, Hermenegildo; Iborra, Sara; et al, Studies in Surface Science and Catalysis, 2001, 135, 3719-3726
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