2-((3-(Trifluoromethyl)phenoxy)methyl)oxirane - CAS 585-45-5
Catalog: |
BB056986 |
Product Name: |
2-((3-(Trifluoromethyl)phenoxy)methyl)oxirane |
CAS: |
585-45-5 |
Synonyms: |
2-[3-(trifluoromethyl)phenoxymethyl]oxirane; 2-[[3-(trifluoromethyl)phenoxy]methyl]oxirane; 2-{[3-(trifluoromethyl)phenoxy]methyl}oxirane |
IUPAC Name: | 2-[[3-(trifluoromethyl)phenoxy]methyl]oxirane |
Description: | 2-((3-(Trifluoromethyl)phenoxy)methyl)oxirane is a useful research chemical compound. |
Molecular Weight: | 218.17 |
Molecular Formula: | C10H9O2F3 |
Canonical SMILES: | C1C(O1)COC2=CC=CC(=C2)C(F)(F)F |
InChI: | InChI=1S/C10H9F3O2/c11-10(12,13)7-2-1-3-8(4-7)14-5-9-6-15-9/h1-4,9H,5-6H2 |
InChI Key: | NBXFAQFMTDGEQN-UHFFFAOYSA-N |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 218.05546401 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 218.05546401 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 21.8Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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