Compound C9H5BrF3N3O2

6-bromo-5-methyl-4-nitro-2-(trifluoromethyl)-1H-benzimidazole

CAS: 89427-24-7

Molecular Formula	`C9H5BrF3N3O2`
Molecular Weight	324.05 g/mol
LogP	3.3
Topological Polar Surface Area	74.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	0
Exact Mass	322.95172
Heavy Atoms	18
Complexity	349.0

Chemical Identifiers

CAS Number	89427-24-7
SMILES	`CC1=C(C=C2C(=C1[N+](=O)[O-])N=C(N2)C(F)(F)F)Br`
InChIKey	`YUYRQXBFESASPO-UHFFFAOYSA-N`

📖 Product Overview

Compound C9H5BrF3N3O2 (CAS: 89427-24-7) is a chemical compound with molecular formula C9H5BrF3N3O2 and molecular weight 324.05 g/mol. Its IUPAC systematic name is 6-bromo-5-methyl-4-nitro-2-(trifluoromethyl)-1H-benzimidazole. LogP 3.3 Topological Polar Surface Area 74.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 0 Exact Mass 322.95172 Heavy Atoms 18 Complexity 349.0 InChI Key: YUYRQXBFESASPO-UHFFFAOYSA-N. SMILES: CC1=C(C=C2C(=C1[N+](=O)[O-])N=C(N2)C(F)(F)F)Br.

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