6-Bromo-1,5-naphthyridin-2(1H)-one - CAS 1246554-89-1
Catalog: |
BB005965 |
Product Name: |
6-Bromo-1,5-naphthyridin-2(1H)-one |
CAS: |
1246554-89-1 |
Synonyms: |
6-bromo-1H-1,5-naphthyridin-2-one; 6-bromo-1H-1,5-naphthyridin-2-one |
IUPAC Name: | 6-bromo-1H-1,5-naphthyridin-2-one |
Description: | 6-Bromo-1,5-naphthyridin-2(1H)-one (CAS# 1246554-89-1 ) is a useful research chemical. |
Molecular Weight: | 225.04 |
Molecular Formula: | C8H5BrN2O |
Canonical SMILES: | C1=CC(=NC2=C1NC(=O)C=C2)Br |
InChI: | InChI=1S/C8H5BrN2O/c9-7-3-1-6-5(10-7)2-4-8(12)11-6/h1-4H,(H,11,12) |
InChI Key: | AEESBURLPZBSOO-UHFFFAOYSA-N |
Complexity: | 229 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 223.95853 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 223.95853 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 42 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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