7-Fluoro-1H-indole-3-carbaldehyde - CAS 126921-16-2
Catalog: |
BB046732 |
Product Name: |
7-Fluoro-1H-indole-3-carbaldehyde |
CAS: |
126921-16-2 |
Synonyms: |
7-fluoroindole-3-carboxaldehyde; 1H-Indole-3-carboxaldehyde, 7-fluoro- |
IUPAC Name: | 7-fluoro-1H-indole-3-carbaldehyde |
Description: | 7-Fluoro-1H-indole-3-carbaldehyde (CAS# 126921-16-2 ) is a useful research chemical. |
Molecular Weight: | 163.15 |
Molecular Formula: | C9H6FNO |
Canonical SMILES: | C1=CC2=C(C(=C1)F)NC=C2C=O |
InChI: | InChI=1S/C9H6FNO/c10-8-3-1-2-7-6(5-12)4-11-9(7)8/h1-5,11H |
InChI Key: | AHVRLLVALCYEEP-UHFFFAOYSA-N |
Boiling Point: | 342.423 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.386 g/cm3 |
Complexity: | 185 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 163.043341977 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 163.043341977 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 32.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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