| CAS Number | 939771-50-3 |
| Catalog Number | AG006AEN(AGN-PC-0WA8JY) |
| Chemical Name | 3-Cyano-5-phenylphenol |
| IUPAC Name | 3-hydroxy-5-phenylbenzonitrile |
| InChI | InChI=1S/C13H9NO/c14-9-10-6-12(8-13(15)7-10)11-4-2-1-3-5-11/h1-8,15H |
| InChI Key | XBLWYBDRUBPMAI-UHFFFAOYSA-N |
| MDL Number | MFCD18314129 |
| Molecular Formula | C13H9NO |
| Molecular Weight | 195.2167 |
| SMILES | N#Cc1cc(O)cc(c1)c1ccccc1 |
| Synonyms | 3-CYANO-5-PHENYLPHENOL,
939771-50-3,
ACMC-209rof,
SCHEMBL1028853,
5-hydroxybiphenyl-3-carbonitrile,
CTK8B2728,
DTXSID70684598,
XBLWYBDRUBPMAI-UHFFFAOYSA-N,
ANW-40141,
MFCD18314129,
ZINC65341265,
AKOS006316414,
5-Hydroxy[1,1'-biphenyl]-3-carbonitrile,
TC-128886,
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| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.221g/mol |
| Monoisotopic Mass | 195.068g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 44A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number