3-Iodo-6-(trifluoromethyl)-5-azaindole - CAS 1190315-69-5
Catalog: |
BB004383 |
Product Name: |
3-Iodo-6-(trifluoromethyl)-5-azaindole |
CAS: |
1190315-69-5 |
Synonyms: |
3-iodo-6-(trifluoromethyl)-1H-pyrrolo[3,2-c]pyridine; 3-iodo-6-(trifluoromethyl)-1H-pyrrolo[3,2-c]pyridine |
IUPAC Name: | 3-iodo-6-(trifluoromethyl)-1H-pyrrolo[3,2-c]pyridine |
Description: | 3-Iodo-6-(trifluoromethyl)-5-azaindole (CAS# 1190315-69-5) is a building block reagent used in the synthesis of pharmaceuticals. |
Molecular Weight: | 312.03 |
Molecular Formula: | C8H4F3IN2 |
Canonical SMILES: | C1=C2C(=CN=C1C(F)(F)F)C(=CN2)I |
InChI: | InChI=1S/C8H4F3IN2/c9-8(10,11)7-1-6-4(2-14-7)5(12)3-13-6/h1-3,13H |
InChI Key: | JQRGNYWBIZSWQB-UHFFFAOYSA-N |
Complexity: | 221 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 311.93713 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 311.93713 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 28.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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