Cas no 99246-99-8 (5-hydroxy-3-methyl-2-Benzofurancarboxylic acid)
99246-99-8 structure
Product Name:5-hydroxy-3-methyl-2-Benzofurancarboxylic acid
CAS No:99246-99-8
MF:C10H8O4
MW:192.168123245239
CID:2107810
PubChem ID:14579217
Update Time:2025-04-21
5-hydroxy-3-methyl-2-Benzofurancarboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 5-hydroxy-3-methyl-2-Benzofurancarboxylic acid
- FMHWXKPNZSRSGS-UHFFFAOYSA-N
- 99246-99-8
- methyl 5-hydroxybenzofuran-2-carboxylic acid
- DA-19908
- SCHEMBL5287590
-
- Inchi： 1S/C10H8O4/c1-5-7-4-6(11)2-3-8(7)14-9(5)10(12)13/h2-4,11H,1H3,(H,12,13)
- InChI Key： FMHWXKPNZSRSGS-UHFFFAOYSA-N
- SMILES： O1C(C(=O)O)=C(C)C2C=C(C=CC1=2)O
Computed Properties
- Exact Mass: 192.04225873Da
- Monoisotopic Mass: 192.04225873Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 240
- 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: 2.2
- Topological Polar Surface Area: 70.7?2
5-hydroxy-3-methyl-2-Benzofurancarboxylic acid Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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