| CAS Number | 155503-85-8 |
| Catalog Number | AG01B6JX |
| Chemical Name | 4-Hydroxy-2-phenylbenzoic acid |
| IUPAC Name | 4-hydroxy-2-phenylbenzoic acid |
| InChI | InChI=1S/C13H10O3/c14-10-6-7-11(13(15)16)12(8-10)9-4-2-1-3-5-9/h1-8,14H,(H,15,16) |
| InChI Key | IPXDGHZTUBSPSG-UHFFFAOYSA-N |
| MDL Number | MFCD24488459 |
| Molecular Formula | C13H10O3 |
| Molecular Weight | 214.2167 |
| SMILES | OC(C1=C(C2=CC=CC=C2)C=C(O)C=C1)=O |
| Synonyms | 4-hydroxy-2-phenylbenzoic acid,
155503-85-8,
SCHEMBL3040769,
ZINC71611138,
|
| Complexity | 246 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.22g/mol |
| Monoisotopic Mass | 214.063g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number