Cas no 7779-66-0 (2-Furanbutanoic acid, 3-methylbutyl ester)
7779-66-0 structure
Product Name:2-Furanbutanoic acid, 3-methylbutyl ester
CAS No:7779-66-0
MF:C13H20O3
MW:224.296104431152
CID:983817
Update Time:2026-04-29
2-Furanbutanoic acid, 3-methylbutyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Furanbutanoic acid, 3-methylbutyl ester
- 3-methylbutyl 4-(furan-2-yl)butanoate
- 3-Methylbutyl 2-furanbutanoate
- 3-Methylbutyl 2-furanbutyrate
- 3-Methylbutyl 2-furylbutyrate
- FEMA No. 2070
- Isoamyl 2-furanbutyrate
- Isopentyl 2-furanbutyrate
-
Computed Properties
- Exact Mass: 224.14100
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 8
- Complexity: 201
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 3.2
Experimental Properties
- PSA: 39.44000
- LogP: 3.19160
- FEMA: 2070 | ISOAMYL 4(2-FURAN)BUTYRATE
2-Furanbutanoic acid, 3-methylbutyl ester Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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