| CAS Number | 1260385-03-2 |
| Catalog Number | AG000QTT(AGN-PC-0WD7LF) |
| Chemical Name | 3-Fluoro-1H-Pyrrolo[2,3-B]Pyridine |
| IUPAC Name | 3-fluoro-1H-pyrrolo[2,3-b]pyridine |
| InChI | InChI=1S/C7H5FN2/c8-6-4-10-7-5(6)2-1-3-9-7/h1-4H,(H,9,10) |
| InChI Key | PASBFEOKJALVMO-UHFFFAOYSA-N |
| MDL Number | MFCD18381415 |
| Molecular Formula | C7H5FN2 |
| Molecular Weight | 136.1264 |
| SMILES | Fc1c[nH]c2ncccc12 |
| Synonyms | 3-fluoro-1H-pyrrolo[2,3-b]pyridine,
1260385-03-2,
SCHEMBL12605500,
KS-000005ST,
MFCD18381415,
ZINC26050452,
SB14341,
1H-Pyrrolo[2,3-b]pyridine, 3-fluoro-,
AS-52582,
CS-0051370,
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| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 136.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 136.129g/mol |
| Monoisotopic Mass | 136.044g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 28.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
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