Cas no 89966-32-5 (2-Butenedioic acid, 2-hydroxy-, 4-ethyl 1-methyl ester)
89966-32-5 structure
Product Name:2-Butenedioic acid, 2-hydroxy-, 4-ethyl 1-methyl ester
CAS No:89966-32-5
MF:C7H10O5
MW:174.151302814484
CID:584639
PubChem ID:71327032
Update Time:2025-04-19
2-Butenedioic acid, 2-hydroxy-, 4-ethyl 1-methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Butenedioic acid, 2-hydroxy-, 4-ethyl 1-methyl ester
- 4-O-ethyl 1-O-methyl 2-hydroxybut-2-enedioate
- 4-ETHYL 1-METHYL 2-HYDROXYBUT-2-ENEDIOATE
- DTXSID70756143
- 89966-32-5
-
- Inchi： 1S/C7H10O5/c1-3-12-6(9)4-5(8)7(10)11-2/h4,8H,3H2,1-2H3
- InChI Key： IYVCZUIWARVGNN-UHFFFAOYSA-N
- SMILES： O(C(C=C(C(=O)OC)O)=O)CC
Computed Properties
- Exact Mass: 174.05282342g/mol
- Monoisotopic Mass: 174.05282342g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 5
- Complexity: 206
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 1
- Topological Polar Surface Area: 72.8?2
2-Butenedioic acid, 2-hydroxy-, 4-ethyl 1-methyl ester Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
89966-32-5 (2-Butenedioic acid, 2-hydroxy-, 4-ethyl 1-methyl ester) Related Products
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