Cas no 248595-18-8 (2-Chloro-4,5-dimethoxybenzonitrile)
248595-18-8 structure
Product Name:2-Chloro-4,5-dimethoxybenzonitrile
CAS No:248595-18-8
MF:C9H8ClNO2
MW:197.618321418762
CID:2101821
Update Time:2023-08-03
2-Chloro-4,5-dimethoxybenzonitrile Chemical and Physical Properties
Names and Identifiers
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- 2-chloro-4,5-dimethoxybenzonitrile
- 2-Chloro-4,5-dimethoxybenzonitrile
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- Inchi： 1S/C9H8ClNO2/c1-12-8-3-6(5-11)7(10)4-9(8)13-2/h3-4H,1-2H3
- InChI Key： ZHXBGZCEEJYNGE-UHFFFAOYSA-N
- SMILES： ClC1C(C#N)=CC(=C(C=1)OC)OC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 213
- Topological Polar Surface Area: 42.2
2-Chloro-4,5-dimethoxybenzonitrile Related Literature
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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