4-Allyl-5-fluoro-1H-pyrrolo[2,3-b]pyridine - CAS 1228665-89-1
Catalog: |
BB005550 |
Product Name: |
4-Allyl-5-fluoro-1H-pyrrolo[2,3-b]pyridine |
CAS: |
1228665-89-1 |
Synonyms: |
5-fluoro-4-prop-2-enyl-1H-pyrrolo[2,3-b]pyridine |
IUPAC Name: | 5-fluoro-4-prop-2-enyl-1H-pyrrolo[2,3-b]pyridine |
Description: | 4-Allyl-5-fluoro-1H-pyrrolo[2,3-b]pyridine (CAS# 1228665-89-1) is a useful research chemical. |
Molecular Weight: | 176.19 |
Molecular Formula: | C10H9FN2 |
Canonical SMILES: | C=CCC1=C2C=CNC2=NC=C1F |
InChI: | InChI=1S/C10H9FN2/c1-2-3-7-8-4-5-12-10(8)13-6-9(7)11/h2,4-6H,1,3H2,(H,12,13) |
InChI Key: | HEFTUUKTEVFJJF-UHFFFAOYSA-N |
MDL: | MFCD16628248 |
LogP: | 2.43050 |
Complexity: | 195 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.07497646 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.07497646 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 28.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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