4,4,5,5,5-Pentafluoropentyl Methanesulfonate - CAS 252947-01-6
Catalog: |
BB018846 |
Product Name: |
4,4,5,5,5-Pentafluoropentyl Methanesulfonate |
CAS: |
252947-01-6 |
Synonyms: |
methanesulfonic acid 4,4,5,5,5-pentafluoropentyl ester; 4,4,5,5,5-pentafluoropentyl methanesulfonate |
IUPAC Name: | 4,4,5,5,5-pentafluoropentyl methanesulfonate |
Description: | 4,4,5,5,5-Pentafluoropentyl Methanesulfonate (CAS# 252947-01-6 ) is a useful research chemical. |
Molecular Weight: | 256.19 |
Molecular Formula: | C6H9F5O3S |
Canonical SMILES: | CS(=O)(=O)OCCCC(C(F)(F)F)(F)F |
InChI: | InChI=1S/C6H9F5O3S/c1-15(12,13)14-4-2-3-5(7,8)6(9,10)11/h2-4H2,1H3 |
InChI Key: | MFRVGMDZPRZPDM-UHFFFAOYSA-N |
LogP: | 3.02120 |
Publication Number | Title | Priority Date |
AU-2016317469-A1 | Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto | 20150904 |
AU-2016317469-B2 | Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto | 20150904 |
CA-2996508-A1 | Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto | 20150904 |
EP-3344040-A1 | Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto | 20150904 |
TW-201718568-A | Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto | 20150904 |
Complexity: | 289 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 256.01925613 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 8 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 256.01925613 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 51.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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