4-Chloro-6,8-dimethylquinoline - CAS 196803-72-2
Catalog: |
BB015209 |
Product Name: |
4-Chloro-6,8-dimethylquinoline |
CAS: |
196803-72-2 |
Synonyms: |
4-chloro-6,8-dimethylquinoline |
IUPAC Name: | 4-chloro-6,8-dimethylquinoline |
Description: | 4-Chloro-6,8-dimethylquinoline (CAS# 196803-72-2) is a useful research chemical. |
Molecular Weight: | 191.66 |
Molecular Formula: | C11H10ClN |
Canonical SMILES: | CC1=CC2=C(C=CN=C2C(=C1)C)Cl |
InChI: | InChI=1S/C11H10ClN/c1-7-5-8(2)11-9(6-7)10(12)3-4-13-11/h3-6H,1-2H3 |
InChI Key: | OREYGYAAYFXMIZ-UHFFFAOYSA-N |
Boiling Point: | 294.2 °C at 760 mmHg |
Density: | 1.188 g/cm3 |
LogP: | 3.50500 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2020150674-A1 | Heterocyclic compounds as adenosine antagonists | 20190118 |
EP-1549634-A1 | Novel substituted indoles | 20020530 |
JP-2005534646-A | New substituted indole | 20020530 |
JP-4564843-B2 | New substituted indole | 20020530 |
TW-200307542-A | Novel compounds | 20020530 |
Complexity: | 183 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.050177 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.050177 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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