7-chloro-2-(propan-2-yl)-2H-pyrazolo[3,4-d]pyridazine - CAS 1823876-43-2
Catalog: |
BB013959 |
Product Name: |
7-chloro-2-(propan-2-yl)-2H-pyrazolo[3,4-d]pyridazine |
CAS: |
1823876-43-2 |
Synonyms: |
7-chloro-2-propan-2-ylpyrazolo[3,4-d]pyridazine; 7-chloro-2-propan-2-ylpyrazolo[3,4-d]pyridazine |
IUPAC Name: | 7-chloro-2-propan-2-ylpyrazolo[3,4-d]pyridazine |
Description: | 7-chloro-2-(propan-2-yl)-2H-pyrazolo[3,4-d]pyridazine (CAS# 1823876-43-2 ) is a useful research chemical. |
Molecular Weight: | 196.638 |
Molecular Formula: | C8H9ClN4 |
Canonical SMILES: | CC(C)N1C=C2C=NN=C(C2=N1)Cl |
InChI: | InChI=1S/C8H9ClN4/c1-5(2)13-4-6-3-10-11-8(9)7(6)12-13/h3-5H,1-2H3 |
InChI Key: | KHZBQRXYSKLIGL-UHFFFAOYSA-N |
Complexity: | 187 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.051574 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.051574 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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