6-(Trifluoromethyl)-5-azaindole - CAS 1190315-48-0
Catalog: |
BB004381 |
Product Name: |
6-(Trifluoromethyl)-5-azaindole |
CAS: |
1190315-48-0 |
Synonyms: |
6-(trifluoromethyl)-1H-pyrrolo[3,2-c]pyridine; 6-(trifluoromethyl)-1H-pyrrolo[3,2-c]pyridine |
IUPAC Name: | 6-(trifluoromethyl)-1H-pyrrolo[3,2-c]pyridine |
Description: | 6-(Trifluoromethyl)-5-azaindole (CAS# 1190315-48-0) is a useful research chemical. |
Molecular Weight: | 186.13 |
Molecular Formula: | C8H5F3N2 |
Canonical SMILES: | C1=CNC2=CC(=NC=C21)C(F)(F)F |
InChI: | InChI=1S/C8H5F3N2/c9-8(10,11)7-3-6-5(4-13-7)1-2-12-6/h1-4,12H |
InChI Key: | RQRNGNXMVKBYGT-UHFFFAOYSA-N |
LogP: | 2.58170 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 192 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.04048265 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.04048265 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 28.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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