4-Chloro-2,5,7-trimethylquinoline - CAS 63136-64-1
Catalog: |
BB032024 |
Product Name: |
4-Chloro-2,5,7-trimethylquinoline |
CAS: |
63136-64-1 |
Synonyms: |
4-chloro-2,5,7-trimethylquinoline |
IUPAC Name: | 4-chloro-2,5,7-trimethylquinoline |
Description: | 4-Chloro-2,5,7-trimethylquinoline (CAS# 63136-64-1) is a useful research chemical. |
Molecular Weight: | 205.68 |
Molecular Formula: | C12H12ClN |
Canonical SMILES: | CC1=CC(=C2C(=C1)N=C(C=C2Cl)C)C |
InChI: | InChI=1S/C12H12ClN/c1-7-4-8(2)12-10(13)6-9(3)14-11(12)5-7/h4-6H,1-3H3 |
InChI Key: | IQBVBMMNGRIPEI-UHFFFAOYSA-N |
Boiling Point: | 304.7 ℃ at 760 mmHg |
Density: | 1.158 g/cm3 |
LogP: | 3.81340 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard] |
Precautionary Statement: | P264, P270, P273, P301+P316, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-5756517-A | Use of bisquinoline compounds in the treatment of cerebral disorders | 19961025 |
Complexity: | 207 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.0658271 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.0658271 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.9 |
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