| CAS Number | 1261891-04-6 |
| Catalog Number | AG00HJEP(AGN-PC-0WNPNQ) |
| Chemical Name | 4-(2,4-Dichlorophenyl)-2-fluorophenol |
| IUPAC Name | 4-(2,4-dichlorophenyl)-2-fluorophenol |
| InChI | InChI=1S/C12H7Cl2FO/c13-8-2-3-9(10(14)6-8)7-1-4-12(16)11(15)5-7/h1-6,16H |
| InChI Key | PBUGWWVOYDZJLV-UHFFFAOYSA-N |
| MDL Number | MFCD18313937 |
| Molecular Formula | C12H7Cl2FO |
| Molecular Weight | 257.0878 |
| SMILES | Clc1ccc(c(c1)Cl)c1ccc(c(c1)F)O |
| Synonyms | 4-(2,4-DICHLOROPHENYL)-2-FLUOROPHENOL,
1261891-04-6,
DTXSID00684440,
MFCD18313937,
ZINC65341074,
AKOS017557829,
2',4'-Dichloro-3-fluoro-biphenyl-4-ol,
2',4'-Dichloro-3-fluoro[1,1'-biphenyl]-4-ol,
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| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 255.986g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 257.085g/mol |
| Monoisotopic Mass | 255.986g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number