4-(4-Amino-phenoxy)-pyridine-2-carbonitrile - CAS 630125-69-8
Catalog: |
BB074378 |
Product Name: |
4-(4-Amino-phenoxy)-pyridine-2-carbonitrile |
CAS: |
630125-69-8 |
Synonyms: |
4-(4-aminophenoxy)pyridine-2-carbonitrile; 4-(4-Aminophenoxy)picolinonitrile; 4-(4-Amino-phenoxy)-pyridine-2-carbonitrile |
IUPAC Name: | 4-(4-aminophenoxy)pyridine-2-carbonitrile |
Molecular Weight: | 211.21 |
Molecular Formula: | C12H9N3O |
Canonical SMILES: | C1=CC(=CC=C1N)OC2=CC(=NC=C2)C#N |
InChI: | InChI=1S/C12H9N3O/c13-8-10-7-12(5-6-15-10)16-11-3-1-9(14)2-4-11/h1-7H,14H2 |
InChI Key: | GRAZISXKEOERSH-UHFFFAOYSA-N |
Complexity: | 265 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.074561919 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.074561919 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 71.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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