| CAS Number | 1261975-80-7 |
| Catalog Number | AG009WTQ(AGN-PC-0WA5XL) |
| Chemical Name | 2-[4-(Ethoxycarbonyl)-3-fluorophenyl]phenol |
| IUPAC Name | ethyl 2-fluoro-4-(2-hydroxyphenyl)benzoate |
| InChI | InChI=1S/C15H13FO3/c1-2-19-15(18)12-8-7-10(9-13(12)16)11-5-3-4-6-14(11)17/h3-9,17H,2H2,1H3 |
| InChI Key | BPRFVYXAWIBRDZ-UHFFFAOYSA-N |
| MDL Number | MFCD18313010 |
| Molecular Formula | C15H13FO3 |
| Molecular Weight | 260.2603 |
| SMILES | CCOC(=O)c1ccc(cc1F)c1ccccc1O |
| Synonyms | 2-[4-(ETHOXYCARBONYL)-3-FLUOROPHENYL]PHENOL,
1261975-80-7,
DTXSID50683620,
MFCD18313010,
ZINC65340141,
Z9255,
Ethyl 3-fluoro-2'-hydroxy[1,1'-biphenyl]-4-carboxylate,
C15H13FO3,
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| Complexity | 308 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 260.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.264g/mol |
| Monoisotopic Mass | 260.085g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number