3-Bromo-6-fluoroindole - CAS 1094754-90-1
Catalog: |
BB002491 |
Product Name: |
3-Bromo-6-fluoroindole |
CAS: |
1094754-90-1 |
Synonyms: |
3-bromo-6-fluoro-1H-indole; 3-bromo-6-fluoro-1H-indole |
IUPAC Name: | 3-bromo-6-fluoro-1H-indole |
Description: | 3-Bromo-6-fluoroindole (CAS# 1094754-90-1 ) is a useful research chemical. |
Molecular Weight: | 214.03 |
Molecular Formula: | C8H5BrFN |
Canonical SMILES: | C1=CC2=C(C=C1F)NC=C2Br |
InChI: | InChI=1S/C8H5BrFN/c9-7-4-11-8-3-5(10)1-2-6(7)8/h1-4,11H |
InChI Key: | QFWZYCWYNOMSQC-UHFFFAOYSA-N |
LogP: | 3.06950 |
Publication Number | Title | Priority Date |
WO-2021083060-A1 | Five-membered heterocyclic oxocarboxylic acid compound and medical use thereof | 20191028 |
EP-1813611-B1 | 1-substituted-3- beta-d-glycopyranosylated nitrogenous hetero- cyclic compounds and medicines containing the same | 20041118 |
Complexity: | 153 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 212.95894 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 212.95894 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 15.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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