2-甲基-3-糠酸甲酯 | 6141-58-8
中文名称:
2-甲基-3-糠酸甲酯
英文名称:
Methyl 2-methyl-3-furoate
CAS No.:
6141-58-8
分子式:
C7 H8 O3
分子量:
140.13662
名称和标识符
MDL
MFCD00003249
InChIKey
UVRRIABXNIGUJZ-UHFFFAOYSA-N
Inchi
1S/C7H8O3/c1-5-6(3-4-10-5)7(8)9-2/h3-4H,1-2H3
SMILES
CC1=C(C=CO1)C(=O)OC
BRN
1342040
别名信息
- 中文别名 -
2-甲基-3-糠酸甲酯
甲基2-甲基呋喃甲酯
2-甲基-3-糠酸甲
2-甲基呋喃甲酯
- 英文别名 -
Methyl 2-methylfuran-3-carboxylate
Methyl 2-methyl-3-furoate
Methyl 2-methyl-3-furancarboxylate
methyl 2-methylfurane-3-carboxylate
J-800079
METHYL-2-METHYL-3-FUROATE
J-800079
SCHEMBL701960
METHYL-2-METHYL-3-FUROATE
6141-58-8
SCHEMBL701960
2-methylfuran-3-carboxylic acid methyl ester
6141-58-8
EINECS 228-132-6
2-methylfuran-3-carboxylic acid methyl ester
DTXSID40210343
EINECS 228-132-6
3-Furancarboxylic acid, 2-methyl-, methyl ester
DTXSID40210343
EN300-18727
CS-0098016
3-Furancarboxylic acid, 2-methyl-, methyl ester
Methyl 2-methyl-3-furoate #
EN300-18727
METHYL2-METHYL-3-FUROATE
CS-0098016
J-640077
Methyl 2-methyl-3-furoate #
W-110085
METHYL2-METHYL-3-FUROATE
A849586
J-640077
AKOS000119414
W-110085
2-Methyl-furan-3-carboxylic acid methyl ester
A849586
AS-43527
AKOS000119414
FT-0612942
2-Methyl-furan-3-carboxylic acid methyl ester
NS00034679
AS-43527
Methyl 2-methyl-3-furancarboxylate, 99%
FT-0612942
2-Methyl Furan-3-Carboxylic Acid Methyl Ester
NS00034679
MFCD00003249
Methyl 2-methyl-3-furancarboxylate, 99%
3-Furoic acid, 2-methyl-, methyl ester
2-Methyl Furan-3-Carboxylic Acid Methyl Ester
MFCD00003249
3-Furoic acid, 2-methyl-, methyl ester
物化性质
实验特性
LogP
1.37460
PSA
39.44000
折射率
n20/D 1.473(lit.)
沸点
75 °C/20 mmHg(lit.)
蒸气压
1.1±0.3 mmHg at 25°C
闪点
华氏:149 °F 摄氏:65 °C
颜色与性状
无色液体
溶解性
未确定
密度
1.116 g/mL at 25 °C(lit.)
计算特性
精确分子量
140.04700
氢键供体数量
0
氢键受体数量
3
可旋转化学键数量
2
同位素质量
140.047
重原子数量
10
复杂度
133
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)
1.2
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
39.4A^2
海关数据
海关编码
2932190090
海关数据
中国海关编码:
2932190090
概述:
2932190090 其他结构上有非稠合呋喃环化合物. 增值税率:17.0% 退税率:9.0% 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
Summary:
2932190090 other compounds containing an unfused furan ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%
相关文献
1.
Low catalyst loading ligand-free palladium-catalyzed direct arylation of furans: an economically and environmentally attractive access to 5-arylfurans
Jia Jia Dong,Julien Roger,Franc Po?gan,Henri Doucet Green Chem. 2009 11 1832
2.
Low catalyst loading ligand-free palladium-catalyzed direct arylation of furans: an economically and environmentally attractive access to 5-arylfurans
Jia Jia Dong,Julien Roger,Franc Po?gan,Henri Doucet Green Chem. 2009 11 1832
3.
Low catalyst loading ligand-free palladium-catalyzed direct arylation of furans: an economically and environmentally attractive access to 5-arylfurans
Jia Jia Dong,Julien Roger,Franc Po?gan,Henri Doucet Green Chem. 2009 11 1832
4.
Synthesis, characterization and catalytic behaviour of a palladium complex bearing a hydroxy-functionalized N-heterocyclic carbene ligand
Annaluisa Mariconda,Fabia Grisi,Chiara Costabile,Salvatore Falcone,Valerio Bertolasi,Pasquale Longo New J. Chem. 2014 38 762
5.
Reactivity of bromofluorenes in palladium-catalysed direct arylation of heteroaromatics
Imen Smari,Liqin Zhao,Kedong Yuan,Hamed Ben Ammar,Henri Doucet Catal. Sci. Technol. 2014 4 3723
6.
Direct C–H heteroarylation by an acenaphthyl-based α-diimine palladium complex: improvement of the reaction efficiency for bi(hetero)aryls under aerobic conditions
Fu-Min Chen,Fei-Dong Huang,Xue-Yi Yao,Tian Li,Feng-Shou Liu Org. Chem. Front. 2017 4 2336
7.
Excited-state cobaloxime catalysis enabled scalable oxidant-free dehydrogenative C–H phosphinoylation of undirected heterocycles
Ailong Shao,Jifang Chen,Lingxiao Wang,Mingchen Yi,Han Yang,Yuqing Zhang,Suhua Fan,Shuisheng Chen,Hai Wu,Renyi Shi Org. Chem. Front. 2022 9 4379
8.
The pyrethrins and related compounds. Part XII. 5-Substituted 3-furoates and 3-thenoates, intermediates for synthesis of insecticidal esters
M. Elliott,N. F. Janes,B. C. Pearson J. Chem. Soc. C 1971 2551
9.
Photochemistry of the nitrogen–thiocarbonyl systems. Part. 24. Photoreactions of thiobenzamide with various substituted furans: regioselective β-benzoylation and transformation of furans to other aromatic compounds
Kazuaki Oda,Hisao Tsujita,Kosei Ohno,Minoru Machida J. Chem. Soc. Perkin Trans. 1 1995 2931
10.
Electron-rich heteroaroylphosphonates and their reaction with trimethyl phosphite
D. Vaughan Griffiths,Mohamad J. Al-Jeboori,Yuen-Ki Cheong,Philip Duncanson,Jayne E. Harris,Michael C. Salt,Helen V. Taylor Org. Biomol. Chem. 2008 6 577
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