Cas no 1007197-75-2 (5-(4-Chlorophenyl)furan-3-carboxylic acid)
1007197-75-2 structure
Product Name:5-(4-Chlorophenyl)furan-3-carboxylic acid
CAS No:1007197-75-2
MF:C11H7ClO3
MW:222.624482393265
CID:840827
Update Time:2023-08-03
5-(4-Chlorophenyl)furan-3-carboxylic acid Chemical and Physical Properties
Names and Identifiers
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- 5-(4-Chloro-phenyl)-furan-2-carboxylic acid
- 5-(4-chlorophenyl)furan-3-carboxylic acid
- 5-(4-Chlorophenyl)furan-3-carboxylic acid
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- Inchi： 1S/C11H7ClO3/c12-9-3-1-7(2-4-9)10-5-8(6-15-10)11(13)14/h1-6H,(H,13,14)
- InChI Key： KJFXPFMNNVEOTP-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)C1=CC(C(=O)O)=CO1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 236
- XLogP3: 2.8
- Topological Polar Surface Area: 50.4
5-(4-Chlorophenyl)furan-3-carboxylic acid Related Literature
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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