Cas no 1246867-36-6 (Methyl 1-isopropyl-1H-indazole-6-carboxylate)
1246867-36-6 structure
Product Name:Methyl 1-isopropyl-1H-indazole-6-carboxylate
CAS No:1246867-36-6
MF:C12H14N2O2
MW:218.251762866974
CID:2109096
Update Time:2023-08-04
Methyl 1-isopropyl-1H-indazole-6-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- methyl 1-isopropyl-1H-indazole-6-carboxylate
- DEEFDHHJEASOQV-UHFFFAOYSA-N
- Methyl 1-isopropyl-1H-indazole-6-carboxylate
-
- Inchi： 1S/C12H14N2O2/c1-8(2)14-11-6-9(12(15)16-3)4-5-10(11)7-13-14/h4-8H,1-3H3
- InChI Key： DEEFDHHJEASOQV-UHFFFAOYSA-N
- SMILES： O(C)C(C1C=CC2C=NN(C=2C=1)C(C)C)=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 268
- Topological Polar Surface Area: 44.1
Methyl 1-isopropyl-1H-indazole-6-carboxylate Related Literature
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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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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