3-(2-Hydroxyphenyl)pyridine-2-carbonitrile - CAS 1420800-31-2
Catalog: |
BB060906 |
Product Name: |
3-(2-Hydroxyphenyl)pyridine-2-carbonitrile |
CAS: |
1420800-31-2 |
Synonyms: |
3-(2-Hydroxyphenyl)pyridine-2-carbonitrile; 2-Pyridinecarbonitrile, 3-(2-hydroxyphenyl)- |
IUPAC Name: | 3-(2-hydroxyphenyl)pyridine-2-carbonitrile |
Description: | 3-(2-Hydroxyphenyl)pyridine-2-carbonitrile |
Molecular Weight: | 196.2 |
Molecular Formula: | C12H8N2O |
Canonical SMILES: | C1=CC=C(C(=C1)C2=C(N=CC=C2)C#N)O |
InChI: | InChI=1S/C12H8N2O/c13-8-11-9(5-3-7-14-11)10-4-1-2-6-12(10)15/h1-7,15H |
InChI Key: | LQGRMKVZUUBOKD-UHFFFAOYSA-N |
Complexity: | 258 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.063662883 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 56.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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