1-chloro-7-(trifluoromethyl)phthalazine - CAS 1352934-00-9
Catalog: |
BB008128 |
Product Name: |
1-chloro-7-(trifluoromethyl)phthalazine |
CAS: |
1352934-00-9 |
Synonyms: |
1-chloro-7-(trifluoromethyl)phthalazine; 1-chloro-7-(trifluoromethyl)phthalazine |
IUPAC Name: | 1-chloro-7-(trifluoromethyl)phthalazine |
Description: | 1-chloro-7-(trifluoromethyl)phthalazine (CAS# 1352934-00-9 ) is a useful research chemical. |
Molecular Weight: | 232.59 |
Molecular Formula: | C9H4ClF3N2 |
Canonical SMILES: | C1=CC2=CN=NC(=C2C=C1C(F)(F)F)Cl |
InChI: | InChI=1S/C9H4ClF3N2/c10-8-7-3-6(9(11,12)13)2-1-5(7)4-14-15-8/h1-4H |
InChI Key: | YHOKQYHXGUDNIC-UHFFFAOYSA-N |
LogP: | 3.30200 |
Publication Number | Title | Priority Date |
AU-2011268375-A1 | Cyclohexyl-azetidinyl antagonists of CCR2 | 20100617 |
AU-2011268375-B2 | Cyclohexyl-azetidinyl antagonists of CCR2 | 20100617 |
CA-2801934-A1 | Cyclohexyl-azetidinyl antagonists of ccr2 | 20100617 |
EP-2582692-A1 | Cyclohexyl-azetidinyl antagonists of ccr2 | 20100617 |
EP-2582692-B1 | Cyclohexyl-azetidinyl antagonists of ccr2 | 20100617 |
Complexity: | 234 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 232.0015103 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 232.0015103 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 25.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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