3-Iodo-1H-indazole - CAS 66607-27-0
Catalog: |
BB033067 |
Product Name: |
3-Iodo-1H-indazole |
CAS: |
66607-27-0 |
Synonyms: |
3-iodo-2H-indazole; 3-iodo-2H-indazole |
IUPAC Name: | 3-iodo-2H-indazole |
Description: | 3-Iodo-1H-indazole (CAS# 66607-27-0) is a useful research chemical. |
Molecular Weight: | 244.03 |
Molecular Formula: | C7H5IN2 |
Canonical SMILES: | C1=CC2=C(NN=C2C=C1)I |
InChI: | InChI=1S/C7H5IN2/c8-7-5-3-1-2-4-6(5)9-10-7/h1-4H,(H,9,10) |
InChI Key: | UDKYMMQGPNFWDA-UHFFFAOYSA-N |
Boiling Point: | 206.934 °C at 760 mmHg |
Density: | 2.083 g/cm3 |
MDL: | MFCD04972469 |
LogP: | 2.16750 |
Publication Number | Title | Priority Date |
CN-111995577-A | Synthetic method of 4-fluoro indazole 3-carbonitrile or derivatives thereof | 20200909 |
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PMID | Publication Date | Title | Journal |
22162199 | 20120102 | Design, synthesis and biological evaluation of Trypanosoma brucei trypanothione synthetase inhibitors | ChemMedChem |
Complexity: | 129 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 243.94975 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 243.94975 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 28.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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