| CAS Number | 1378525-26-8 |
| Catalog Number | AG0198DK(AGN-PC-0WBQ1U) |
| Chemical Name | 2,2-Difluorocyclopentane-1-carboxylic acid |
| IUPAC Name | 2,2-difluorocyclopentane-1-carboxylic acid |
| InChI | InChI=1S/C6H8F2O2/c7-6(8)3-1-2-4(6)5(9)10/h4H,1-3H2,(H,9,10) |
| InChI Key | XSLQMFZQUKYHKR-UHFFFAOYSA-N |
| MDL Number | MFCD18909234 |
| Molecular Formula | C6H8F2O2 |
| Molecular Weight | 150.1233 |
| SMILES | O=C(C1C(F)(F)CCC1)O |
| Synonyms | 2,2-difluorocyclopentane-1-carboxylic acid,
1378525-26-8,
2,2-Difluorocyclopentanecarboxylic acid,
(R)-2,2-Difluorocyclopentane-1-carboxylic acid,
SCHEMBL20488174,
2166223-17-0,
AKOS023201382,
MCULE-3687597013,
NE44660,
(1S)-2,2-Difluorocyclopentane-1-carboxylic acid,
F1907-0016,
Z1868430581,
2166030-98-2,
|
| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 150.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 150.125g/mol |
| Monoisotopic Mass | 150.049g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number