| CAS Number | 1602871-83-9 |
| Catalog Number | AG01DVRG |
| Chemical Name | 1-[(4-fluoro-2-methylphenyl)methyl]cyclopropane-1-carboxylic acid |
| IUPAC Name | 1-[(4-fluoro-2-methylphenyl)methyl]cyclopropane-1-carboxylic acid |
| InChI | InChI=1S/C12H13FO2/c1-8-6-10(13)3-2-9(8)7-12(4-5-12)11(14)15/h2-3,6H,4-5,7H2,1H3,(H,14,15) |
| InChI Key | XOMWZAUOVHNMTN-UHFFFAOYSA-N |
| MDL Number | MFCD31666670 |
| Molecular Formula | C12H13FO2 |
| Molecular Weight | 208.2288 |
| SMILES | CC1=C(CC2(C(O)=O)CC2)C=CC(F)=C1 |
| Synonyms | 1-[(4-fluoro-2-methylphenyl)methyl]cyclopropane-1-carboxylic acid,
1602871-83-9,
|
| Complexity | 260 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.232g/mol |
| Monoisotopic Mass | 208.09g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number