4-Chloro-2-hydroxy-8-trifluoromethylquinoline - CAS 955288-52-5
Catalog: |
BB041747 |
Product Name: |
4-Chloro-2-hydroxy-8-trifluoromethylquinoline |
CAS: |
955288-52-5 |
Synonyms: |
4-chloro-8-(trifluoromethyl)-1H-quinolin-2-one |
IUPAC Name: | 4-chloro-8-(trifluoromethyl)-1H-quinolin-2-one |
Description: | 4-Chloro-2-hydroxy-8-trifluoromethylquinoline (CAS# 955288-52-5 ) is a useful research chemical. |
Molecular Weight: | 247.60 |
Molecular Formula: | C10H5ClF3NO |
Canonical SMILES: | C1=CC2=C(C(=C1)C(F)(F)F)NC(=O)C=C2Cl |
InChI: | InChI=1S/C10H5ClF3NO/c11-7-4-8(16)15-9-5(7)2-1-3-6(9)10(12,13)14/h1-4H,(H,15,16) |
InChI Key: | PQCSVYRBDRJKHQ-UHFFFAOYSA-N |
Boiling Point: | 355.1 °C at 760 mmHg |
Density: | 1.53 g/cm3 |
LogP: | 3.20030 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P316, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021146341-A1 | Platelet storage methods and compositions | 20200115 |
Complexity: | 339 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 247.001176 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 247.001176 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 29.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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