2-[4-(2,2,2-Trifluoroethoxy)phenyl]ethylamine - CAS 170015-96-0
Catalog: |
BB012596 |
Product Name: |
2-[4-(2,2,2-Trifluoroethoxy)phenyl]ethylamine |
CAS: |
170015-96-0 |
Synonyms: |
2-[4-(2,2,2-trifluoroethoxy)phenyl]ethanamine; 2-[4-(2,2,2-trifluoroethoxy)phenyl]ethanamine |
IUPAC Name: | 2-[4-(2,2,2-trifluoroethoxy)phenyl]ethanamine |
Description: | 2-[4-(2,2,2-Trifluoroethoxy)phenyl]ethylamine (CAS# 170015-96-0) is a useful research chemical. |
Molecular Weight: | 219.20 |
Molecular Formula: | C10H12F3NO |
Canonical SMILES: | C1=CC(=CC=C1CCN)OCC(F)(F)F |
InChI: | InChI=1S/C10H12F3NO/c11-10(12,13)7-15-9-3-1-8(2-4-9)5-6-14/h1-4H,5-7,14H2 |
InChI Key: | LEWYHTQOEBEEKN-UHFFFAOYSA-N |
LogP: | 2.82920 |
Publication Number | Title | Priority Date |
EP-3814356-A1 | Triazolotriazine derivatives as a2a receptor antagonists | 20180626 |
WO-2009145718-A1 | Isoindoline derivatives comprising an additional heterocyclic group and their use in the treatment of pain disorders | 20080530 |
EP-1966156-A2 | New compounds iii | 20051223 |
WO-2007073303-A2 | Novel benzimidazole derivatives as vanilloid receptor 1 (vrl) inhibitors | 20051223 |
JP-H08269021-A | 4-Aminopyrimidine derivative, its manufacturing method and pest control agent for agricultural and horticultural use | 19950330 |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.08709849 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.08709849 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 35.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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