Cas no 14863-41-3 (1H-Benzimidazole,5,7-dichloro-6-methyl-2-(trifluoromethyl)-)
14863-41-3 structure
Product Name:1H-Benzimidazole,5,7-dichloro-6-methyl-2-(trifluoromethyl)-
CAS No:14863-41-3
MF:C9H5Cl2F3N2
MW:269.050610303879
CID:163184
PubChem ID:326490
Update Time:2025-04-19
1H-Benzimidazole,5,7-dichloro-6-methyl-2-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzimidazole,5,7-dichloro-6-methyl-2-(trifluoromethyl)-
- 4,6-dichloro-5-methyl-2-(trifluoromethyl)-1H-benzimidazole
- NSC298109
- DTXSID90315872
- NSC-298109
- ACQKRACPTVERDI-UHFFFAOYSA-N
- 14863-41-3
-
- Inchi： 1S/C9H5Cl2F3N2/c1-3-4(10)2-5-7(6(3)11)16-8(15-5)9(12,13)14/h2H,1H3,(H,15,16)
- InChI Key： ACQKRACPTVERDI-UHFFFAOYSA-N
- SMILES： ClC1=C(C)C(=CC2=C1N=C(C(F)(F)F)N2)Cl
Computed Properties
- Exact Mass: 266.97052
- Monoisotopic Mass: 267.978
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 274
- 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: 4
- Topological Polar Surface Area: 28.7?2
Experimental Properties
- Density: 1.594
- Boiling Point: 349.6°Cat760mmHg
- Flash Point: 165.2°C
- Refractive Index: 1.58
- PSA: 25.78
1H-Benzimidazole,5,7-dichloro-6-methyl-2-(trifluoromethyl)- Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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