Cas no 62497-27-2 (2,5-Thiophenedicarboxylic acid, 3,4-bis(4-methylphenyl)-)
62497-27-2 structure
Product Name:2,5-Thiophenedicarboxylic acid, 3,4-bis(4-methylphenyl)-
CAS No:62497-27-2
MF:C20H16O4S
MW:352.403644561768
CID:442723
PubChem ID:12294922
Update Time:2025-04-19
2,5-Thiophenedicarboxylic acid, 3,4-bis(4-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2,5-Thiophenedicarboxylic acid, 3,4-bis(4-methylphenyl)-
- 3,4-bis(4-methylphenyl)thiophene-2,5-dicarboxylic acid
- 62497-27-2
- DTXSID00485398
- 3,4-di-p-tolylthiophene-2,5-dicarboxylic acid
-
- Inchi: 1S/C20H16O4S/c1-11-3-7-13(8-4-11)15-16(14-9-5-12(2)6-10-14)18(20(23)24)25-17(15)19(21)22/h3-10H,1-2H3,(H,21,22)(H,23,24)
- InChI Key: RVFRVHAMDWVWLG-UHFFFAOYSA-N
- SMILES: S1C(C(=O)O)=C(C2C=CC(C)=CC=2)C(=C1C(=O)O)C1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 352.07698
- Monoisotopic Mass: 352.07693016g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 25
- Rotatable Bond Count: 4
- Complexity: 448
- 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: 5.3
- Topological Polar Surface Area: 103?2
Experimental Properties
- PSA: 74.6
2,5-Thiophenedicarboxylic acid, 3,4-bis(4-methylphenyl)- Related Literature
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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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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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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L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
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Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
62497-27-2 (2,5-Thiophenedicarboxylic acid, 3,4-bis(4-methylphenyl)-) Related Products
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