Cas no 88796-66-1 (Benzoic acid, 2-[(5-nitro-2-furanyl)methoxy]-, ethyl ester)
![Benzoic acid, 2-[(5-nitro-2-furanyl)methoxy]-, ethyl ester structure](https://ossimg.kuujia.com/scimg/89000/88796-66-1x500.png)
88796-66-1 structure
Product Name:Benzoic acid, 2-[(5-nitro-2-furanyl)methoxy]-, ethyl ester
CAS No:88796-66-1
MF:C14H13NO6
MW:291.256124258041
CID:621382
PubChem ID:127260232
Update Time:2025-04-19
Benzoic acid, 2-[(5-nitro-2-furanyl)methoxy]-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2-[(5-nitro-2-furanyl)methoxy]-, ethyl ester
- ethyl 2-[(5-nitrofuran-2-yl)methoxy]benzoate
- 88796-66-1
- 2-((5-Nitrofuran-2-yl)methoxy)ethyl benzoate
-
- Inchi： 1S/C14H13NO6/c16-14(11-4-2-1-3-5-11)20-9-8-19-10-12-6-7-13(21-12)15(17)18/h1-7H,8-10H2
- InChI Key： XNLSUNYEFDPXEF-UHFFFAOYSA-N
- SMILES： O(CCOC(C1C=CC=CC=1)=O)CC1=CC=C([N+](=O)[O-])O1
Computed Properties
- Exact Mass: 291.07428713g/mol
- Monoisotopic Mass: 291.07428713g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 21
- Rotatable Bond Count: 7
- Complexity: 350
- 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: 2.4
- Topological Polar Surface Area: 94.5?2
Benzoic acid, 2-[(5-nitro-2-furanyl)methoxy]-, ethyl ester Related Literature
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
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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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