| CAS Number | 1261973-27-6 |
| Catalog Number | AG009X0Y(AGN-PC-0WNPOP) |
| Chemical Name | 2-Cyano-4-(4-hydroxyphenyl)phenol |
| IUPAC Name | 2-hydroxy-5-(4-hydroxyphenyl)benzonitrile |
| InChI | InChI=1S/C13H9NO2/c14-8-11-7-10(3-6-13(11)16)9-1-4-12(15)5-2-9/h1-7,15-16H |
| InChI Key | HGZAAWVCEKXGEB-UHFFFAOYSA-N |
| MDL Number | MFCD18314157 |
| Molecular Formula | C13H9NO2 |
| Molecular Weight | 211.2161 |
| SMILES | N#Cc1cc(ccc1O)c1ccc(cc1)O |
| Synonyms | 2-CYANO-4-(4-HYDROXYPHENYL)PHENOL,
1261973-27-6,
DTXSID40684626,
MFCD18314157,
ZINC65341293,
4,4'-Dihydroxy[1,1'-biphenyl]-3-carbonitrile,
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| Complexity | 275 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.22g/mol |
| Monoisotopic Mass | 211.063g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 64.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number