Cas no 90147-24-3 (2-Propenoic acid, 3-(5-nitro-2-furanyl)-, cyanomethyl ester)
90147-24-3 structure
Product Name:2-Propenoic acid, 3-(5-nitro-2-furanyl)-, cyanomethyl ester
CAS No:90147-24-3
MF:C9H6N2O5
MW:222.15434217453
CID:793124
PubChem ID:71430030
Update Time:2025-04-19
2-Propenoic acid, 3-(5-nitro-2-furanyl)-, cyanomethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 3-(5-nitro-2-furanyl)-, cyanomethyl ester
- cyanomethyl 3-(5-nitrofuran-2-yl)prop-2-enoate
- DTXSID40848685
- 90147-24-3
-
- Inchi： 1S/C9H6N2O5/c10-5-6-15-9(12)4-2-7-1-3-8(16-7)11(13)14/h1-4H,6H2
- InChI Key： NQABJVDWTRPRTB-UHFFFAOYSA-N
- SMILES： O1C(=CC=C1C=CC(=O)OCC#N)[N+](=O)[O-]
Computed Properties
- Exact Mass: 222.02767130g/mol
- Monoisotopic Mass: 222.02767130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 351
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 1.4
- Topological Polar Surface Area: 109?2
2-Propenoic acid, 3-(5-nitro-2-furanyl)-, cyanomethyl ester Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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