4-Chloro-2-methyl-6-trifluoromethylquinoline - CAS 867167-05-3
Catalog: |
BB038045 |
Product Name: |
4-Chloro-2-methyl-6-trifluoromethylquinoline |
CAS: |
867167-05-3 |
Synonyms: |
4-chloro-2-methyl-6-(trifluoromethyl)quinoline |
IUPAC Name: | 4-chloro-2-methyl-6-(trifluoromethyl)quinoline |
Description: | 4-Chloro-2-methyl-6-trifluoromethylquinoline (CAS# 867167-05-3) is a useful research chemical. |
Molecular Weight: | 245.63 |
Molecular Formula: | C11H7ClF3N |
Canonical SMILES: | CC1=NC2=C(C=C(C=C2)C(F)(F)F)C(=C1)Cl |
InChI: | InChI=1S/C11H7ClF3N/c1-6-4-9(12)8-5-7(11(13,14)15)2-3-10(8)16-6/h2-5H,1H3 |
InChI Key: | RPZVTQFAPZXWFN-UHFFFAOYSA-N |
Boiling Point: | 277.2 °C at 760 mmHg |
Density: | 1.376 g/cm3 |
LogP: | 4.21540 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
HU-0401607-A2 | Synthesis of aminoquinoline derivatives and of their starting materials | 20040810 |
AU-2005232159-A1 | 2-propene-1-ones as HSP 70 inducers | 20040412 |
AU-2005232159-B2 | 2-propene-1-ones as HSP 70 inducers | 20040412 |
CA-2562130-C | 2-propene-1-ones as hsp 70 inducers | 20040412 |
EP-1748987-A2 | 2-propene-1-ones as hsp 70 inducers | 20040412 |
Complexity: | 256 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 245.0219114 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 245.0219114 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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