Cas no 502164-18-3 (3-Butenoic acid, 4-butoxy-2-oxo-, methyl ester)
502164-18-3 structure
Product Name:3-Butenoic acid, 4-butoxy-2-oxo-, methyl ester
CAS No:502164-18-3
MF:C9H14O4
MW:186.205063343048
CID:1562875
Update Time:2024-08-24
3-Butenoic acid, 4-butoxy-2-oxo-, methyl ester Chemical and Physical Properties
Names and Identifiers
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- 3-Butenoic acid, 4-butoxy-2-oxo-, methyl ester
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- Inchi： 1S/C9H14O4/c1-3-4-6-13-7-5-8(10)9(11)12-2/h5,7H,3-4,6H2,1-2H3
- InChI Key： MCTYPBRTGNHSSO-UHFFFAOYSA-N
- SMILES： C(OC)(=O)C(=O)C=COCCCC
Computed Properties
- Exact Mass: 186.08922
Experimental Properties
- Density: 1.048±0.06 g/cm3(Predicted)
- Boiling Point: 252.0±32.0 °C(Predicted)
- PSA: 52.6
3-Butenoic acid, 4-butoxy-2-oxo-, methyl ester Related Literature
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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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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Jason Wan Lab Chip, 2020,20, 4528-4538
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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