Cas no 1261921-34-9 (4-(4-Carboxy-2-methylphenyl)thiophene-2-carboxylic acid)
1261921-34-9 structure
Product Name:4-(4-Carboxy-2-methylphenyl)thiophene-2-carboxylic acid
CAS No:1261921-34-9
MF:C13H10O4S
MW:262.281102657318
CID:2763606
PubChem ID:53226818
Update Time:2025-04-21
4-(4-Carboxy-2-methylphenyl)thiophene-2-carboxylic acid Chemical and Physical Properties
Names and Identifiers
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- DTXSID10690436
- 1261921-34-9
- 4-(4-Carboxy-2-methylphenyl)thiophene-2-carboxylic acid
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- Inchi： 1S/C13H10O4S/c1-7-4-8(12(14)15)2-3-10(7)9-5-11(13(16)17)18-6-9/h2-6H,1H3,(H,14,15)(H,16,17)
- InChI Key： PMDZUWYUOWFTGH-UHFFFAOYSA-N
- SMILES： S1C(C(=O)O)=CC(=C1)C1C=CC(C(=O)O)=CC=1C
Computed Properties
- Exact Mass: 262.02997997Da
- Monoisotopic Mass: 262.02997997Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 344
- 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: 3
- Topological Polar Surface Area: 103?2
4-(4-Carboxy-2-methylphenyl)thiophene-2-carboxylic acid Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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