Cas no 253679-32-2 (2-Furancarboxylic acid,5-(3-cyanophenyl)-)
253679-32-2 structure
Product Name:2-Furancarboxylic acid,5-(3-cyanophenyl)-
CAS No:253679-32-2
MF:C12H7NO3
MW:213.188883066177
CID:246697
PubChem ID:4189590
Update Time:2025-04-19
2-Furancarboxylic acid,5-(3-cyanophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Furancarboxylic acid,5-(3-cyanophenyl)-
- 5-(3-Cyanophenyl)-furane-2-carboxylic acid
- 5-(3-cyanophenyl)furan-2-carboxylic acid
- CHEMBL4648479
- 253679-32-2
- BB 0223020
- SCHEMBL3739232
- AKOS004117335
- 5-(3-Cyanophenyl)-2-furoic acid
- DTXSID70400553
- M83
-
- Inchi： 1S/C12H7NO3/c13-7-8-2-1-3-9(6-8)10-4-5-11(16-10)12(14)15/h1-6H,(H,14,15)
- InChI Key： ZBBYBWMLIOUQRN-UHFFFAOYSA-N
- SMILES： O1C(C(=O)O)=CC=C1C1C=CC=C(C#N)C=1
Computed Properties
- Exact Mass: 213.04261
- Monoisotopic Mass: 213.043
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 320
- 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
- Topological Polar Surface Area: 74.2A^2
- XLogP3: 2.2
Experimental Properties
- PSA: 74.23
2-Furancarboxylic acid,5-(3-cyanophenyl)- Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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2. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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5. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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