5-Chloro-6-fluoro-[1,2,3,4]tetrazolo[1,5-a]pyridine-8-carbonitrile - CAS 1393442-50-6
Catalog: |
BB069427 |
Product Name: |
5-Chloro-6-fluoro-[1,2,3,4]tetrazolo[1,5-a]pyridine-8-carbonitrile |
CAS: |
1393442-50-6 |
Synonyms: |
5-Chloro-6-fluoro-[1,2,3,4]tetrazolo[1,5-a]pyridine-8-carbonitrile; 5-chloro-6-fluorotetrazolo[1,5-a]pyridine-8-carbonitrile |
IUPAC Name: | 5-chloro-6-fluorotetrazolo[1,5-a]pyridine-8-carbonitrile |
Description: | 5-Chloro-6-fluoro-[1,2,3,4]tetrazolo[1,5-a]pyridine-8-carbonitrile |
Molecular Weight: | 197.56 |
Molecular Formula: | C6HClFN5 |
Canonical SMILES: | C1=C(C2=NN=NN2C(=C1F)Cl)C#N |
InChI: | InChI=1S/C6HClFN5/c7-5-4(8)1-3(2-9)6-10-11-12-13(5)6/h1H |
InChI Key: | ISZCKYJNQBZCPH-UHFFFAOYSA-N |
Complexity: | 253 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.9904509 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.9904509 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 66.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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