Cas no 192571-85-0 (Acetic acid 4,5-dimethoxypyridin-3-yl ester)
192571-85-0 structure
Product Name:Acetic acid 4,5-dimethoxypyridin-3-yl ester
CAS No:192571-85-0
MF:C9H11NO4
MW:197.187942743301
CID:907949
Update Time:2023-08-02
Acetic acid 4,5-dimethoxypyridin-3-yl ester Chemical and Physical Properties
Names and Identifiers
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- 3-Pyridinol,4,5-dimethoxy-,acetate(ester)(9CI)
- 4,5-dimethoxypyridin-3-yl acetate
- 3-Pyridinol, 4,5-dimethoxy-, 3-acetate
- Acetic acid 4,5-dimethoxypyridin-3-yl ester
-
- Inchi： 1S/C9H11NO4/c1-6(11)14-8-5-10-4-7(12-2)9(8)13-3/h4-5H,1-3H3
- InChI Key： LIJFBIWOENIDOZ-UHFFFAOYSA-N
- SMILES： O(C)C1C(=CN=CC=1OC(C)=O)OC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 197
- Topological Polar Surface Area: 57.6
Acetic acid 4,5-dimethoxypyridin-3-yl ester Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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