1-[2-Fluoro-4-(trifluoromethyl)phenyl]piperazine - CAS 817170-70-0
Catalog: |
BB036697 |
Product Name: |
1-[2-Fluoro-4-(trifluoromethyl)phenyl]piperazine |
CAS: |
817170-70-0 |
Synonyms: |
1-[2-fluoro-4-(trifluoromethyl)phenyl]piperazine; 1-[2-fluoro-4-(trifluoromethyl)phenyl]piperazine |
IUPAC Name: | 1-[2-fluoro-4-(trifluoromethyl)phenyl]piperazine |
Description: | 1-[2-Fluoro-4-(trifluoromethyl)phenyl]piperazine (CAS# 817170-70-0) is a useful research chemical. |
Molecular Weight: | 248.22 |
Molecular Formula: | C11H12F4N2 |
Canonical SMILES: | C1CN(CCN1)C2=C(C=C(C=C2)C(F)(F)F)F |
InChI: | InChI=1S/C11H12F4N2/c12-9-7-8(11(13,14)15)1-2-10(9)17-5-3-16-4-6-17/h1-2,7,16H,3-6H2 |
InChI Key: | FJDNYOZEHRTOLO-UHFFFAOYSA-N |
LogP: | 2.64790 |
Publication Number | Title | Priority Date |
CN-105712928-A | 2-Substituted-oxy-5-methylsulfonyl pyridine piperazine acidamide analogue and preparation method and application thereof | 20141222 |
AU-2005307006-A1 | Sulfonyl-substituted bicyclic compounds as modulators of PPAR | 20041029 |
AU-2005307006-B2 | Sulfonyl-substituted bicyclic compounds as modulators of PPAR | 20041029 |
CA-2585172-A1 | Sulfonyl-substituted bicyclic compounds as modulators of ppar | 20041029 |
CA-2585172-C | Sulfonyl-substituted bicyclic compounds as modulators of ppar | 20041029 |
Complexity: | 250 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 248.09366104 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 248.09366104 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 15.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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