Cas no 90557-59-8 (4,6-Dimethoxy-1H-benzo[d]imidazole)
90557-59-8 structure
Product Name:4,6-Dimethoxy-1H-benzo[d]imidazole
CAS No:90557-59-8
MF:C9H10N2O2
MW:178.187901973724
CID:798452
Update Time:2023-08-03
4,6-Dimethoxy-1H-benzo[d]imidazole Chemical and Physical Properties
Names and Identifiers
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- 1H-Benzimidazole,5,7-dimethoxy-
- 1H-Benzimidazole,4,6-dimethoxy-(9CI)
- 4,6-dimethoxy-1H-benzo[d]imidazole
- 4,6-Dimethoxy-1H-benzo[d]imidazole
-
- Inchi: 1S/C9H10N2O2/c1-12-6-3-7-9(11-5-10-7)8(4-6)13-2/h3-5H,1-2H3,(H,10,11)
- InChI Key: HBLXSQBRJKXYPA-UHFFFAOYSA-N
- SMILES: O(C)C1=CC(=CC2=C1N=CN2)OC
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 177
- Topological Polar Surface Area: 47.1
4,6-Dimethoxy-1H-benzo[d]imidazole Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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