Cas no 166952-92-7 (2-(Methoxycarbonyl)benzofuran-5-carboxylic acid)
166952-92-7 structure
Product Name:2-(Methoxycarbonyl)benzofuran-5-carboxylic acid
CAS No:166952-92-7
MF:C11H8O5
MW:220.178223609924
CID:1084844
PubChem ID:73553872
Update Time:2025-04-20
2-(Methoxycarbonyl)benzofuran-5-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 2-(Methoxycarbonyl)benzofuran-5-carboxylic acid
- 2-(Methoxycarbonyl)-1-benzofuran-5-carboxylic acid
- 166952-92-7
-
- Inchi： 1S/C11H8O5/c1-15-11(14)9-5-7-4-6(10(12)13)2-3-8(7)16-9/h2-5H,1H3,(H,12,13)
- InChI Key： IKYXACPCFDUFDX-UHFFFAOYSA-N
- SMILES： O1C(C(=O)OC)=CC2C=C(C(=O)O)C=CC1=2
Computed Properties
- Exact Mass: 220.03717335g/mol
- Monoisotopic Mass: 220.03717335g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 301
- 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: 2.1
- Topological Polar Surface Area: 76.7?2
2-(Methoxycarbonyl)benzofuran-5-carboxylic acid Related Literature
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
-
Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
166952-92-7 (2-(Methoxycarbonyl)benzofuran-5-carboxylic acid) Related Products
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
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