1XS
5-(3-chloro-4-fluorophenyl)furan-2-carboxylic acid
Find entries where: 1XS
is present as a standalone ligand in 2 entries
Chemical Component Summary | |
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Name | 5-(3-chloro-4-fluorophenyl)furan-2-carboxylic acid |
Identifiers | 5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-carboxylic acid |
Formula | C11 H6 Cl F O3 |
Molecular Weight | 240.615 |
Type | NON-POLYMER |
Isomeric SMILES | c1cc(c(cc1c2ccc(o2)C(=O)O)Cl)F |
InChI | InChI=1S/C11H6ClFO3/c12-7-5-6(1-2-8(7)13)9-3-4-10(16-9)11(14)15/h1-5H,(H,14,15) |
InChIKey | MGUVQRGVUWXOGD-UHFFFAOYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 22 |
Chiral Atom Count | 0 |
Bond Count | 23 |
Aromatic Bond Count | 11 |
Related Resource References
Resource Name | Reference |
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PubChem | 2992775 |
ChEMBL | CHEMBL3088226 |