Catalog | OFC1263379050-1 |
CAS | 1263379-05-0 |
Category | Fluorinated Benzimidazoles |
Synonyms | 5,6-difluoro-1H-1,3-benzodiazole-2-carbaldehyde |
Purity | 98+% |
MDL Number | MFCD18432482 |
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IUPAC Name | 5,6-difluoro-1H-benzimidazole-2-carbaldehyde |
InChI | InChI=1S/C8H4F2N2O/c9-4-1-6-7(2-5(4)10)12-8(3-13)11-6/h1-3H,(H,11,12) |
InChI Key | AICAAERLDDWAQO-UHFFFAOYSA-N |
Isomeric SMILES | C1=C2C(=CC(=C1F)F)N=C(N2)C=O |
Molecular Formula | C8H4F2N2O |
Molecular Weight | 182.13 |
XLogP3-AA | 1.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 1 |
Exact Mass | 182.02916908 g/mol |
Monoisotopic Mass | 182.02916908 g/mol |
Topological Polar Surface Area | 45.8Ų |
Heavy Atom Count | 13 |
Formal Charge | 0 |
Complexity | 214 |
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