2-Cyano-5-(4-cyanophenyl)phenol - CAS 1261973-55-0
Catalog: |
BB069151 |
Product Name: |
2-Cyano-5-(4-cyanophenyl)phenol |
CAS: |
1261973-55-0 |
Synonyms: |
3-Hydroxy-[1,1'-biphenyl]-4,4'-dicarbonitrile; 2-CYANO-5-(4-CYANOPHENYL)PHENOL; 4-(4-cyanophenyl)-2-hydroxybenzonitrile |
IUPAC Name: | 4-(4-cyanophenyl)-2-hydroxybenzonitrile |
Description: | 2-Cyano-5-(4-cyanophenyl)phenol |
Molecular Weight: | 220.23 |
Molecular Formula: | C14H8N2O |
Canonical SMILES: | C1=CC(=CC=C1C#N)C2=CC(=C(C=C2)C#N)O |
InChI: | InChI=1S/C14H8N2O/c15-8-10-1-3-11(4-2-10)12-5-6-13(9-16)14(17)7-12/h1-7,17H |
InChI Key: | FDINFKGWUIEHAF-UHFFFAOYSA-N |
Complexity: | 353 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.063662883 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 67.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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