3-Bromo-6-methoxy-1H-pyrrolo[2,3-b]pyridine - CAS 1190317-52-2
Catalog: |
BB004388 |
Product Name: |
3-Bromo-6-methoxy-1H-pyrrolo[2,3-b]pyridine |
CAS: |
1190317-52-2 |
Synonyms: |
3-bromo-6-methoxy-1H-pyrrolo[2,3-b]pyridine; 3-bromo-6-methoxy-1H-pyrrolo[2,3-b]pyridine |
IUPAC Name: | 3-bromo-6-methoxy-1H-pyrrolo[2,3-b]pyridine |
Description: | 3-Bromo-6-methoxy-1H-pyrrolo[2,3-b]pyridine (CAS# 1190317-52-2 ) is a useful research chemical. |
Molecular Weight: | 227.06 |
Molecular Formula: | C8H7BrN2O |
Canonical SMILES: | COC1=NC2=C(C=C1)C(=CN2)Br |
InChI: | InChI=1S/C8H7BrN2O/c1-12-7-3-2-5-6(9)4-10-8(5)11-7/h2-4H,1H3,(H,10,11) |
InChI Key: | ISENGFMRAAURKN-UHFFFAOYSA-N |
Complexity: | 167 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 225.97418 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 225.97418 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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