Cas no 30671-39-7 (Butanoic acid, 3-oxo-, (5-nitro-2-furanyl)methyl ester)
30671-39-7 structure
Product Name:Butanoic acid, 3-oxo-, (5-nitro-2-furanyl)methyl ester
CAS No:30671-39-7
MF:C9H9NO6
MW:227.170862913132
CID:1447218
Update Time:2024-08-25
Butanoic acid, 3-oxo-, (5-nitro-2-furanyl)methyl ester Chemical and Physical Properties
Names and Identifiers
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- Butanoic acid, 3-oxo-, (5-nitro-2-furanyl)methyl ester
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- Inchi： 1S/C9H9NO6/c1-6(11)4-9(12)15-5-7-2-3-8(16-7)10(13)14/h2-3H,4-5H2,1H3
- InChI Key： FYQUNDGFEWABKS-UHFFFAOYSA-N
- SMILES： C(OCC1=CC=C([N+]([O-])=O)O1)(=O)CC(=O)C
Computed Properties
- Exact Mass: 227.04297
Experimental Properties
- Density: 1.360±0.06 g/cm3(Predicted)
- Boiling Point: 351.9±32.0 °C(Predicted)
- PSA: 99.65
- pka: 10.02±0.46(Predicted)
Butanoic acid, 3-oxo-, (5-nitro-2-furanyl)methyl ester Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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