| CAS Number | 1394793-36-2 |
| Catalog Number | AG01A0GP |
| Chemical Name | 2-(2-Fluoro-5-methylphenoxy)acetic acid |
| IUPAC Name | 2-(2-fluoro-5-methylphenoxy)acetic acid |
| InChI | InChI=1S/C9H9FO3/c1-6-2-3-7(10)8(4-6)13-5-9(11)12/h2-4H,5H2,1H3,(H,11,12) |
| InChI Key | JCFRRAPQGHMBLT-UHFFFAOYSA-N |
| MDL Number | MFCD20429669 |
| Molecular Formula | C9H9FO3 |
| Molecular Weight | 184.1644 |
| SMILES | CC1=CC(OCC(O)=O)=C(F)C=C1 |
| Synonyms | 2-(2-fluoro-5-methylphenoxy)acetic acid,
1394793-36-2,
SCHEMBL765038,
MFCD20429669,
ZINC78869211,
AKOS014182805,
(2-Fluoro-5-methylphenoxy)acetic acid,
MCULE-3338573561,
NE21486,
|
| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.166g/mol |
| Monoisotopic Mass | 184.054g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number