Methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2,2-dibromoacetate - CAS 318967-86-1
Catalog: |
BB043468 |
Product Name: |
Methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2,2-dibromoacetate |
CAS: |
318967-86-1 |
Synonyms: |
Methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2,2-dibromo-acetate; CTK1B9551; DTXSID70572825; AKOS017343516 |
IUPAC Name: | methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2,2-dibromoacetate |
Description: | Methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2,2-dibromoacetate (CAS# 318967-86-1 ) is a useful research chemical. |
Molecular Weight: | 475.90 |
Molecular Formula: | C7H7Br2F6O5P |
Canonical SMILES: | COC(=O)C(P(=O)(OCC(F)(F)F)OCC(F)(F)F)(Br)Br |
InChI: | InChI=1S/C7H7Br2F6O5P/c1-18-4(16)7(8,9)21(17,19-2-5(10,11)12)20-3-6(13,14)15/h2-3H2,1H3 |
InChI Key: | WQKORYQQLDAFDJ-UHFFFAOYSA-N |
Complexity: | 401 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 475.82816 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 11 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 473.8302 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 61.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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