顺丁烯二酸单甲酯 | 3052-50-4
中文名称:
顺丁烯二酸单甲酯
英文名称:
Maleic Acid Monomethyl Ester (~90%)
CAS No.:
3052-50-4
分子式:
C5 H6 O4
分子量:
130.09874
名称和标识符
MDL
MFCD00045905
InChIKey
NKHAVTQWNUWKEO-IHWYPQMZSA-N
Inchi
InChI=1S/C5H6O4/c1-9-5(8)3-2-4(6)7/h2-3H,1H3,(H,6,7)/b3-2-
SMILES
COC(=O)/C=C\C(=O)O
别名信息
- 中文别名 -
顺丁烯二酸单甲酯
马来酸单甲酯
(Z)-2-丁烯二酸单甲酯
Monomethyl Maleate 马来酸单甲酯
顺丁烯二酸单甲酯(MMM)
- 英文别名 -
Maleicacidmonomethylester
2-Butenedioic acid, monomethyl ester
Maleic Acid Monometh
Monomethyl maleate
Maleic acid 1-hydrogen 4-methyl ester
Maleic acid 1-methyl
Maleic acid hydrogen 1-methyl ester
Maleinsaeure-monomethylester
Meleic acid monomethyl ester
methyl hydrogen (2Z)-2-butendioate
methyl hydrogen but-2-enedioate
methyl hydrogen maleate
methyl maleate
MMM
Monomethylmaleinate
(Z)-2-Butenedioic acid monomethyl ester
Maleic Acid Monomethyl Ester
(2E)-4-Methoxy-4-oxo-2-butenoic acid
Maleic acid, monomethyl ester
NSC 11205
DTXCID209251
NSC11205
Fumaric acid, methyl ester
Fumaric acid, monomethyl ester
Maleic Acid Monomethyl Ester (~90per cent)
CS-0187530
NSC-11205
2-Butenedioic acid (2Z)-, 1-methyl ester
U3UT1G2B9N
NSC525206
AKOS006230198
Methyl hydrogen (2Z)-2-butendioate
3052-50-4
CAS-3052-50-4
BS-49106
2-Butenedioic acid (E)-, monomethyl ester
NS00005398
NSC-525206
(Z)-4-methoxy-4-oxobut-2-enoic acid
(2Z)-4-methoxy-4-oxobut-2-enoic acid
MFCD00045905
DTXSID1029251
Q27290652
maleic acid-monomethyl ester
NSC 525206
NCGC00255203-01
EINECS 221-271-3
UNII-U3UT1G2B9N
2-Butenedioic acid (Z)-, monomethyl ester
EN300-1440004
NSC523835
Tox21_301490
maleic monomethyl ester
Maleic Acid Monomethyl Ester (~90%)
Methyl hydrogen maleate
E78069
2-Butenedioic acid (2Z)-, monomethyl ester
LMFA07010962
Monomethyl (Z)-2-butenedioate
M0624
SCHEMBL126468
Hydrogen methyl maleate
CHEMBL3181865
物化性质
实验特性
LogP
-0.19980
PSA
63.6
折射率
1.4620-1.4660
沸点
250.0±23.0 °C at 760 mmHg
熔点
No data available
蒸气压
0.0±1.1 mmHg at 25°C
闪点
108.9±16.1 °C
颜色与性状
无可用
溶解性
无可用
密度
1.26
计算特性
精确分子量
130.02658
氢键供体数量
1
氢键受体数量
4
可旋转化学键数量
3
同位素质量
130.027
重原子数量
9
复杂度
147
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)
0.4
表面电荷
0
拓扑分子极性表面积
63.6
相关文献
1.
Carbon-13 nuclear magnetic resonance of unsymmetrically ortho-disubstituted benzenes. Spectral analysis of phthalic and maleic acid monoesters
Choo-Seng Giam,Thomas E. Goodwin,Tair ku Yano J. Chem. Soc. Perkin Trans. 2 1978 831
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Hiromasa Ikeda,Erika Kaneko,Shunsuke Okuzawa,Daisuke Takahashi,Kazunobu Toshima Org. Biomol. Chem. 2014 12 8832
4.
Synthesis of α,β-unsaturated esters of perfluoropolyalkylethers (PFPAEs) based on hexafluoropropylene oxide units for photopolymerization
Céline Bonneaud,Mélanie Decostanzi,Julia Burgess,Giuseppe Trusiano,Trevor Burgess,Roberta Bongiovanni,Christine Joly-Duhamel,Chadron M. Friesen RSC Adv. 2018 8 32664
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Tungsten catalysed decarboxylative [3 + 2] cycloaddition aromatization: one-pot synthesis of trifluoromethyl-pyrrolo[2,1-a]isoquinolines with visible light irradiation
Daohong Yu,Yungen Liu,Chi-Ming Che Org. Chem. Front. 2022 9 2779
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An automated computational approach to kinetic model discrimination and parameter estimation
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Plant oil renewable resources as green alternatives in polymer science
Michael A. R. Meier,Jürgen O. Metzger,Ulrich S. Schubert Chem. Soc. Rev. 2007 36 1788
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Solvent-free Wittig olefination with stabilized phosphoranes—scope and limitations
Thies Thiemann,Masataka Watanabe,Yasuko Tanaka,Shuntaro Mataka New J. Chem. 2004 28 578
9.
Asymmetric Diels–Alder polymerization using a chirally
modified Lewis acid catalyst
Shinichi Itsuno,Shoichi Tada,Koichi Ito modified Lewis acid catalyst. Shinichi Itsuno Shoichi Tada Koichi Ito Chem. Commun. 1997 933
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J. Halpern,L. E. Orgel Discuss. Faraday Soc. 1960 29 7
参考资料
Reaxys RN
385951
Beilstein
M158075
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