Cas no 1566348-52-4 (methyl 4,5-difluoro-1H-benzo[d]imidazole-2-carboxylate)
![methyl 4,5-difluoro-1H-benzo[d]imidazole-2-carboxylate structure](https://ossimg.kuujia.com/scimg/1566500/1566348-52-4x500.png)
1566348-52-4 structure
Product Name:methyl 4,5-difluoro-1H-benzo[d]imidazole-2-carboxylate
CAS No:1566348-52-4
MF:C9H6F2N2O2
MW:212.152948856354
CID:6833837
PubChem ID:112616540
Update Time:2025-04-03
methyl 4,5-difluoro-1H-benzo[d]imidazole-2-carboxylate Chemical and Physical Properties
Names and Identifiers
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- 1566348-52-4
- SY351914
- Methyl 4,5-difluoro-1H-benzo[d]imidazole-2-carboxylate
- Methyl 4,5-Difluorobenzimidazole-2-carboxylate
- methyl 4,5-difluoro-1H-benzo[d]imidazole-2-carboxylate
-
- Inchi： 1S/C9H6F2N2O2/c1-15-9(14)8-12-5-3-2-4(10)6(11)7(5)13-8/h2-3H,1H3,(H,12,13)
- InChI Key： YHFSNHPZHYCRAY-UHFFFAOYSA-N
- SMILES： FC1=C(C=CC2=C1N=C(C(=O)OC)N2)F
Computed Properties
- Exact Mass: 212.03973376Da
- Monoisotopic Mass: 212.03973376Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 264
- 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: 1.9
- Topological Polar Surface Area: 55?2
methyl 4,5-difluoro-1H-benzo[d]imidazole-2-carboxylate Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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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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