| CAS Number | 669713-85-3 |
| Catalog Number | AG00FAXL(AGN-PC-0TMRNU) |
| Chemical Name | (3'-Fluoro-biphenyl-2-yl)-acetic acid |
| IUPAC Name | 2-[2-(3-fluorophenyl)phenyl]acetic acid |
| InChI | InChI=1S/C14H11FO2/c15-12-6-3-5-10(8-12)13-7-2-1-4-11(13)9-14(16)17/h1-8H,9H2,(H,16,17) |
| InChI Key | BFGLWNMRGCKEOE-UHFFFAOYSA-N |
| MDL Number | MFCD03426489 |
| Molecular Formula | C14H11FO2 |
| Molecular Weight | 230.2343 |
| SMILES | FC1=CC=CC(=C1)C1C=CC=CC=1CC(O)=O |
| Synonyms | 669713-85-3,
(3'-Fluoro-biphenyl-2-yl)-acetic acid,
2-biphenyl-3'-fluoro-acetic acid,
(3'-fluoro-biphenyl-2-yl)acetic acid,
2-(3'-Fluoro-[1,1'-biphenyl]-2-yl)acetic acid,
2-Biphenyl-3'-fluoro-aceticacid,
2-[2-(3-fluorophenyl)phenyl]acetic Acid,
AC1LRCZ9,
SCHEMBL9105295,
CTK7J2424,
DTXSID60362676,
ZINC1258229,
MFCD03426489,
(3'-fluorobiphenyl-2-yl)acetic acid,
2-(3'-fluorobiphenyl-2-yl)acetic acid,
AJ-25246,
X-1828,
CID1393284,
A12771,
|
| Complexity | 267 |
| 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 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number