| CAS Number | 1227580-10-0 |
| Catalog Number | AG01BS3L |
| Chemical Name | 5-Chloro-7-fluoro-1H-indole-3-carbaldehyde |
| IUPAC Name | 5-chloro-7-fluoro-1H-indole-3-carbaldehyde |
| InChI | InChI=1S/C9H5ClFNO/c10-6-1-7-5(4-13)3-12-9(7)8(11)2-6/h1-4,12H |
| InChI Key | GUZPUEIRQNDYPF-UHFFFAOYSA-N |
| MDL Number | MFCD16610360 |
| Molecular Formula | C9H5ClFNO |
| Molecular Weight | 197.5935 |
| SMILES | FC1=C2C(C(C=O)=CN2)=CC(Cl)=C1 |
| Synonyms | 5-chloro-7-fluoro-1H-indole-3-carbaldehyde,
1227580-10-0,
ZINC238593771,
5-Chloro-7-fluoroindole-3-carboxaldehyde,
|
| Complexity | 214 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.004g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.593g/mol |
| Monoisotopic Mass | 197.004g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number