| CAS Number | 1399659-67-6 |
| Catalog Number | AG01B85Z(AGN-PC-0WNNGR) |
| Chemical Name | 1-(2-Fluorophenoxy)cyclopropanecarboxylic acid |
| IUPAC Name | 1-(2-fluorophenoxy)cyclopropane-1-carboxylic acid |
| InChI | InChI=1S/C10H9FO3/c11-7-3-1-2-4-8(7)14-10(5-6-10)9(12)13/h1-4H,5-6H2,(H,12,13) |
| InChI Key | FWDPMQNMDHRTTM-UHFFFAOYSA-N |
| MDL Number | MFCD22420874 |
| Molecular Formula | C10H9FO3 |
| Molecular Weight | 196.1751 |
| SMILES | OC(C1(OC2=C(F)C=CC=C2)CC1)=O |
| Synonyms | 1399659-67-6,
1-(2-Fluorophenoxy)cyclopropanecarboxylic acid,
1-(2-fluorophenoxy)cyclopropane-1-carboxylic acid,
ZINC85392342,
AKOS023673666,
Z1983079578,
1-(2-Fluoro-phenoxy)-cyclopropanecarboxylic acid,
|
| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.177g/mol |
| Monoisotopic Mass | 196.054g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number