| CAS Number | 1152591-07-5 |
| Catalog Number | AG01BDHR |
| Chemical Name | 3-(2,2,3,3-tetrafluoropropoxy)propanoic acid |
| IUPAC Name | 3-(2,2,3,3-tetrafluoropropoxy)propanoic acid |
| InChI | InChI=1S/C6H8F4O3/c7-5(8)6(9,10)3-13-2-1-4(11)12/h5H,1-3H2,(H,11,12) |
| InChI Key | ZGNWNOOHLITDJW-UHFFFAOYSA-N |
| MDL Number | MFCD10693822 |
| Molecular Formula | C6H8F4O3 |
| Molecular Weight | 204.1195 |
| SMILES | OC(CCOCC(C(F)F)(F)F)=O |
| Synonyms | 3-(2,2,3,3-tetrafluoropropoxy)propanoic acid,
1152591-07-5,
ZINC34958317,
AKOS005205516,
MCULE-4253679601,
Z1837077147,
|
| Complexity | 171 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.121g/mol |
| Monoisotopic Mass | 204.041g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number