Cas no 21895-62-5 (1,2,3,4-Benzenetetracarboxylic acid 1,4-dimethyl ester)
21895-62-5 structure
Product Name:1,2,3,4-Benzenetetracarboxylic acid 1,4-dimethyl ester
CAS No:21895-62-5
MF:C12H10O8
MW:282.203004360199
CID:2656662
Update Time:2023-08-06
1,2,3,4-Benzenetetracarboxylic acid 1,4-dimethyl ester Chemical and Physical Properties
Names and Identifiers
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- 1,2,3,4-Benzenetetracarboxylic acid 1,4-dimethyl ester
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- Inchi： 1S/C12H10O8/c1-19-11(17)5-3-4-6(12(18)20-2)8(10(15)16)7(5)9(13)14/h3-4H,1-2H3,(H,13,14)(H,15,16)
- InChI Key： FABKBJPZNANULG-UHFFFAOYSA-N
- SMILES： O(C)C(C1=CC=C(C(=O)OC)C(C(=O)O)=C1C(=O)O)=O
Computed Properties
- Exact Mass: 282.038
- Monoisotopic Mass: 282.038
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 20
- Rotatable Bond Count: 6
- Complexity: 389
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.6
- Topological Polar Surface Area: 127
1,2,3,4-Benzenetetracarboxylic acid 1,4-dimethyl ester Related Literature
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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4. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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