6-Chloro-7-fluoro-1H-indole-3-carbaldehyde - CAS 467457-00-7
Catalog: |
BB044541 |
Product Name: |
6-Chloro-7-fluoro-1H-indole-3-carbaldehyde |
CAS: |
467457-00-7 |
Synonyms: |
3-Formyl-6-chloro-7-fluoro-1H-indole; 1H-Indole-3-carboxaldehyde, 6-chloro-7-fluoro-; 6-Chloro-7-fluoroindole-3-carboxaldehyde |
IUPAC Name: | 6-chloro-7-fluoro-1H-indole-3-carbaldehyde |
Description: | 6-Chloro-7-fluoro-1H-indole-3-carbaldehyde (CAS# 467457-00-7 ) is a useful research chemical. |
Molecular Weight: | 197.59 |
Molecular Formula: | C9H5ClFNO |
Canonical SMILES: | C1=CC(=C(C2=C1C(=CN2)C=O)F)Cl |
InChI: | InChI=1S/C9H5ClFNO/c10-7-2-1-6-5(4-13)3-12-9(6)8(7)11/h1-4,12H |
InChI Key: | HVUDTQDOEZEEQL-UHFFFAOYSA-N |
Boiling Point: | 379.5±37.0 °C (Predicted) |
Purity: | 95 % |
Density: | 1.523±0.06 g/cm3 |
Complexity: | 214 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 197.0043696 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 197.0043696 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 32.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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