Cas no 66414-02-6 (4-ethyl-2-Furancarboxaldehyde)
4-ethyl-2-Furancarboxaldehyde structure
Product Name:4-ethyl-2-Furancarboxaldehyde
CAS No:66414-02-6
MF:C7H8O2
MW:124.137222290039
CID:396344
PubChem ID:21899738
Update Time:2025-04-19
4-ethyl-2-Furancarboxaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 4-ethyl-2-Furancarboxaldehyde
- 4-ethylfuran-2-carbaldehyde
- FT-0735904
- 66414-02-6
- DTXSID50619727
- SCHEMBL1760923
-
- Inchi： 1S/C7H8O2/c1-2-6-3-7(4-8)9-5-6/h3-5H,2H2,1H3
- InChI Key： KYOQLZOZPDVYCB-UHFFFAOYSA-N
- SMILES： O1C(C=O)=CC(=C1)CC
Computed Properties
- Exact Mass: 124.05244
- Monoisotopic Mass: 124.052429494g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 101
- 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: 1.6
- Topological Polar Surface Area: 30.2?2
Experimental Properties
- PSA: 30.21
4-ethyl-2-Furancarboxaldehyde Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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