| CAS Number | 1261969-58-7 |
| Catalog Number | AG00HOTZ(AGN-PC-0WRAB8) |
| Chemical Name | 3-Chloro-5-(2-fluorophenyl)phenol |
| IUPAC Name | 3-chloro-5-(2-fluorophenyl)phenol |
| InChI | InChI=1S/C12H8ClFO/c13-9-5-8(6-10(15)7-9)11-3-1-2-4-12(11)14/h1-7,15H |
| InChI Key | VDHDZHOOPKAUOP-UHFFFAOYSA-N |
| MDL Number | MFCD18315442 |
| Molecular Formula | C12H8ClFO |
| Molecular Weight | 222.6427 |
| SMILES | c1ccc(c(c1)c2cc(cc(c2)Cl)O)F |
| Synonyms | 3-CHLORO-5-(2-FLUOROPHENYL)PHENOL,
1261969-58-7,
5-Chloro-2'-fluoro-[1,1'-biphenyl]-3-ol,
DTXSID10685842,
MFCD18315442,
ZINC65343058,
AKOS027436748,
5-Chloro-2'-fluoro[1,1'-biphenyl]-3-ol,
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| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.643g/mol |
| Monoisotopic Mass | 222.025g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number