Methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2-bromoacetate - CAS 287481-44-1
Catalog: |
BB043463 |
Product Name: |
Methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2-bromoacetate |
CAS: |
287481-44-1 |
Synonyms: |
Methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2-bromo-acetate; Acetic acid, [bis(2,2,2-trifluoroethoxy)phosphinyl]bromo-, methyl ester; Kogen's reagent; CTK0J1855 |
IUPAC Name: | methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2-bromoacetate |
Description: | Methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2-bromoacetate (CAS# 287481-44-1 ) is a useful research chemical. |
Molecular Weight: | 397.00 |
Molecular Formula: | C7H8BrF6O5P |
Canonical SMILES: | COC(=O)C(P(=O)(OCC(F)(F)F)OCC(F)(F)F)Br |
InChI: | InChI=1S/C7H8BrF6O5P/c1-17-5(15)4(8)20(16,18-2-6(9,10)11)19-3-7(12,13)14/h4H,2-3H2,1H3 |
InChI Key: | MMHNTPNKYFALAL-UHFFFAOYSA-N |
Complexity: | 361 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 395.91969 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 11 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 395.91969 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 61.8 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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