4-Chloro-7,8-dimethylquinoline - CAS 181950-53-8
Catalog: |
BB013852 |
Product Name: |
4-Chloro-7,8-dimethylquinoline |
CAS: |
181950-53-8 |
Synonyms: |
4-chloro-7,8-dimethylquinoline |
IUPAC Name: | 4-chloro-7,8-dimethylquinoline |
Description: | 4-Chloro-7,8-dimethylquinoline (CAS# 181950-53-8) is a useful research chemical. |
Molecular Weight: | 191.66 |
Molecular Formula: | C11H10ClN |
Canonical SMILES: | CC1=C(C2=NC=CC(=C2C=C1)Cl)C |
InChI: | InChI=1S/C11H10ClN/c1-7-3-4-9-10(12)5-6-13-11(9)8(7)2/h3-6H,1-2H3 |
InChI Key: | JVVPYRJTPJOCFZ-UHFFFAOYSA-N |
Boiling Point: | 299.5 °C at 760 mmHg |
Density: | 1.188 g/cm3 |
LogP: | 3.50500 |
GHS Hazard Statement: | H301 (97.44%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P310, P305+P351+P338, P310, P321, P330, P405, and P501 |
Signal Word: | Danger |
Complexity: | 183 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.0501770 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.0501770 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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