1-(2-N,N-Dimethylethoxy)-3-trifluoromethylbenzene - CAS 1001541-07-6
Catalog: |
BB066797 |
Product Name: |
1-(2-N,N-Dimethylethoxy)-3-trifluoromethylbenzene |
CAS: |
1001541-07-6 |
Synonyms: |
N,N-Dimethyl-2-(3-(trifluoromethyl)phenoxy)ethanamine; 1-(2-N,N-Dimethylethoxy)-3-trifluoromethylbenzene; N,N-dimethyl-2-[3-(trifluoromethyl)phenoxy]ethanamine |
IUPAC Name: | N,N-dimethyl-2-[3-(trifluoromethyl)phenoxy]ethanamine |
Description: | 1-(2-N,N-Dimethylethoxy)-3-trifluoromethylbenzene |
Molecular Weight: | 233.23 |
Molecular Formula: | C11H14F3NO |
Canonical SMILES: | CN(C)CCOC1=CC=CC(=C1)C(F)(F)F |
InChI: | InChI=1S/C11H14F3NO/c1-15(2)6-7-16-10-5-3-4-9(8-10)11(12,13)14/h3-5,8H,6-7H2,1-2H3 |
InChI Key: | UYYALXLYWVCFOT-UHFFFAOYSA-N |
Complexity: | 206 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.10274856 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.10274856 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 12.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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