4-BROMO-6-(TRIFLUOROMETHYL)BENZIMIDAZOLE-2-THIOL

: Iupac Name：4-bromo-6-(trifluoromethyl)-1,3-dihydrobenzimidazole-2-thione; CAS No.: 175135-17-8; Molecular Weight：297.093; Modify Date.: 2022-11-23 22:10

1. Names and Identifiers

: 1.1 Name; 4-BROMO-6-(TRIFLUOROMETHYL)BENZIMIDAZOLE-2-THIOL; 1.2 Synonyms; 2H-Benzimidazole-2-thione, 4-bromo-1,3-dihydro-6-(trifluoromethyl)- 4-Bromo-1,3-dihydro-6-(trifluoromethyl)-2H-benzimidazole-2-thione 4-Bromo-2-mercapto-6-(trifluoromethyl)benzimidazole 4-bromo-6-(trifluoromethyl)-1,7a-dihydrobenzimidazole-2-thione 4-bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole-2-thiol 4-BROMO-6-(TRIFLUOROMETHYL)BENZIMIDAZOLE-2-THIOL; View all

1.6 Inchi: InChI=1S/C8H4BrF3N2S/c9-4-1-3(8(10,11)12)2-5-6(4)14-7(15)13-5/h1-2H,(H2,13,14,15)

2. Properties

3. Safety and Handling

4. NMR Spectrum

5. Computational chemical data

Molecular Weight: 297.093g/mol
Molecular Formula: C₈H₄BrF₃N₂S
Compound Is Canonicalized: True
XLogP3-AA: 2.7
Exact Mass: 295.92307
Monoisotopic Mass: 295.92307
Complexity: 284
Rotatable Bond Count: 0
Hydrogen Bond Donor Count: 2
Hydrogen Bond Acceptor Count: 4
Topological Polar Surface Area: 56.2
Heavy Atom Count: 15
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADcYBzAYBAEAAAAAAAAAAAAAAAAWAAAAAwAAAAAAAAAFgBAAAAHQRQAAABrAiBGBAxwILAAACEAiRCQACCAAAhAg0AiAAAdKiIYCLAkZGUIAhokAJIyjcQgAAOCAAAUAEAACgQAACgAgAAUAAAAAAAAA==

6. Recommended Suppliers

Global9SuppliersView all >>

Hangzhou J&H Chemical Co., Ltd Audited Suppliers

Products:3,5-Dibromoanisole,5-Fluoro-2-nitroanisole,Doxorubicin hydrochloride,Diethyl 4-oxoheptanedioate,1,5-Diphenylpenta-1,4-dien-3-one,3,5-Dimethoxy-4-hydroxycinnamic acid
Tel:86-571-87396430