Cas no 89909-58-0 (1H-Pyrrole-2,5-dicarboxylic acid, 3-ethyl-4-methyl-)
89909-58-0 structure
Product Name:1H-Pyrrole-2,5-dicarboxylic acid, 3-ethyl-4-methyl-
CAS No:89909-58-0
MF:C9H11NO4
MW:197.187942743301
CID:585434
PubChem ID:44718636
Update Time:2025-04-19
1H-Pyrrole-2,5-dicarboxylic acid, 3-ethyl-4-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrole-2,5-dicarboxylic acid, 3-ethyl-4-methyl-
- 3-ethyl-4-methyl-1H-pyrrole-2,5-dicarboxylic acid
- 89909-58-0
- DTXSID90660334
-
- Inchi： 1S/C9H11NO4/c1-3-5-4(2)6(8(11)12)10-7(5)9(13)14/h10H,3H2,1-2H3,(H,11,12)(H,13,14)
- InChI Key： WPIKJFMJGVZEPL-UHFFFAOYSA-N
- SMILES： OC(C1=C(CC)C(C)=C(C(=O)O)N1)=O
Computed Properties
- Exact Mass: 197.069
- Monoisotopic Mass: 197.069
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 253
- 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
- Topological Polar Surface Area: 90.4A^2
- XLogP3: 1.6
1H-Pyrrole-2,5-dicarboxylic acid, 3-ethyl-4-methyl- Related Literature
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1. 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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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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3. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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