4-{[6-(1H-Pyrazol-1-yl)-4-pyrimidinyl]oxy}benzaldehyde - CAS 1015846-03-3
Catalog: |
BB072696 |
Product Name: |
4-{[6-(1H-Pyrazol-1-yl)-4-pyrimidinyl]oxy}benzaldehyde |
CAS: |
1015846-03-3 |
Synonyms: |
4-{[6-(1H-PYRAZOL-1-YL)-4-PYRIMIDINYL]OXY}BENZALDEHYDE; 4-((6-(1H-Pyrazol-1-yl)pyrimidin-4-yl)oxy)benzaldehyde; 4-(6-pyrazol-1-ylpyrimidin-4-yl)oxybenzaldehyde; 4-((6-(1h-pyrazol-1-yl)-4-pyrimidinyl)oxy)benzaldehyde; 4-([6-(1h-pyrazol-1-yl)-4-pyrimidinyl]oxy)benzaldehyde; 4-{[6-(1H-Pyrazol-1-yl)pyrimidin-4-yl]oxy}benzaldehyde |
IUPAC Name: | 4-(6-pyrazol-1-ylpyrimidin-4-yl)oxybenzaldehyde |
Molecular Weight: | 266.25 |
Molecular Formula: | C14H10N4O2 |
Canonical SMILES: | C1=CN(N=C1)C2=CC(=NC=N2)OC3=CC=C(C=C3)C=O |
InChI: | InChI=1S/C14H10N4O2/c19-9-11-2-4-12(5-3-11)20-14-8-13(15-10-16-14)18-7-1-6-17-18/h1-10H |
InChI Key: | WBGLNODRVAPPED-UHFFFAOYSA-N |
Complexity: | 320 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.08037557 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.08037557 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 69.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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