| CAS Number | 87293-37-6 |
| Catalog Number | AG00GSLX(AGN-PC-0WON7K) |
| Chemical Name | 2-(4'-Fluoro-[1,1'-biphenyl]-2-yl)acetic acid |
| IUPAC Name | 2-[2-(4-fluorophenyl)phenyl]acetic acid |
| InChI | InChI=1S/C14H11FO2/c15-12-7-5-10(6-8-12)13-4-2-1-3-11(13)9-14(16)17/h1-8H,9H2,(H,16,17) |
| InChI Key | OEXCPMVXXPJZES-UHFFFAOYSA-N |
| MDL Number | MFCD03426492 |
| Molecular Formula | C14H11FO2 |
| Molecular Weight | 230.2343 |
| SMILES | FC1C=CC(=CC=1)C1C=CC=CC=1CC(O)=O |
| Synonyms | 2-biphenyl-4'-fluoro-acetic acid,
87293-37-6,
(4-Fluorobiphenyl-2')-acetic acid,
2-(4'-Fluoro-[1,1'-biphenyl]-2-yl)acetic acid,
2-Biphenyl-4'-fluoro-aceticacid,
4'-fluoro-biphenyl-2-acetic acid,
AC1LRCWA,
(4'-fluoro-biphenyl-2-yl)-acetic acid,
2-[2-(4-fluorophenyl)phenyl]acetic Acid,
SCHEMBL3507028,
DTXSID90362669,
OEXCPMVXXPJZES-UHFFFAOYSA-N,
ZINC5764119,
MFCD03426492,
(4'-fluorobiphenyl-2-yl)acetic acid,
AKOS022257123,
2-(4'-fluorobiphenyl-2-yl)acetic acid,
X-1829,
CID1393192,
A12769,
|
| Complexity | 259 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.238g/mol |
| Monoisotopic Mass | 230.074g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number