6-Bromo-3-isopropyl-1H-indazole - CAS 1391123-54-8
Catalog: |
BB008893 |
Product Name: |
6-Bromo-3-isopropyl-1H-indazole |
CAS: |
1391123-54-8 |
Synonyms: |
6-bromo-3-propan-2-yl-2H-indazole; 6-bromo-3-propan-2-yl-2H-indazole |
IUPAC Name: | 6-bromo-3-propan-2-yl-2H-indazole |
Description: | 6-Bromo-3-isopropyl-1H-indazole (CAS# 1391123-54-8) is a useful research chemical. |
Molecular Weight: | 239.11 |
Molecular Formula: | C10H11BrN2 |
Canonical SMILES: | CC(C)C1=C2C=CC(=CC2=NN1)Br |
InChI: | InChI=1S/C10H11BrN2/c1-6(2)10-8-4-3-7(11)5-9(8)12-13-10/h3-6H,1-2H3,(H,12,13) |
InChI Key: | BCOCEYNYPQTAGX-UHFFFAOYSA-N |
LogP: | 3.44880 |
Publication Number | Title | Priority Date |
CA-2880178-A1 | Difluoromethylene compound | 20120727 |
DK-2878594-T3 | DIFLUOROMETHYLENE COMPOUND | 20120727 |
EP-2878594-A1 | Difluoromethylene compound | 20120727 |
EP-2878594-B1 | Difluoromethylene compound | 20120727 |
EP-3444238-A2 | Process for preparing difluoromethylene compounds | 20120727 |
Complexity: | 184 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 238.01056 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 238.01056 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 28.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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