| CAS Number | 1532703-00-6 |
| Catalog Number | AG01BFX4(AGN-PC-0WOT33) |
| Chemical Name | 2-(2,2-Difluorocyclopentyl)acetic acid |
| IUPAC Name | 2-(2,2-difluorocyclopentyl)acetic acid |
| InChI | InChI=1S/C7H10F2O2/c8-7(9)3-1-2-5(7)4-6(10)11/h5H,1-4H2,(H,10,11) |
| InChI Key | KOKUGISIHTUPJT-UHFFFAOYSA-N |
| MDL Number | MFCD28118751 |
| Molecular Formula | C7H10F2O2 |
| Molecular Weight | 164.1499 |
| SMILES | OC(CC1C(F)(F)CCC1)=O |
| Synonyms | 2-(2,2-difluorocyclopentyl)acetic acid,
1532703-00-6,
SCHEMBL10006267,
AKOS023410372,
F8888-1470,
|
| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.152g/mol |
| Monoisotopic Mass | 164.065g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
Lot Number