4,6,7-Trichloroquinoline - CAS 855763-18-7
Catalog: |
BB037652 |
Product Name: |
4,6,7-Trichloroquinoline |
CAS: |
855763-18-7 |
Synonyms: |
4,6,7-trichloroquinoline |
IUPAC Name: | 4,6,7-trichloroquinoline |
Description: | 4,6,7-Trichloroquinoline (CAS# 855763-18-7) is a useful research chemical. |
Molecular Weight: | 232.49 |
Molecular Formula: | C9H4Cl3N |
Canonical SMILES: | C1=CN=C2C=C(C(=CC2=C1Cl)Cl)Cl |
InChI: | InChI=1S/C9H4Cl3N/c10-6-1-2-13-9-4-8(12)7(11)3-5(6)9/h1-4H |
InChI Key: | KGNQNRPJCCCDPE-UHFFFAOYSA-N |
Boiling Point: | 318.6 °C at 760 mmHg |
Density: | 1.523 g/cm3 |
LogP: | 4.19500 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard] |
Precautionary Statement: | P264, P264+P265, P270, P273, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CA-2988342-A1 | Analogues of hydroxychloroquine (hcq) without retinal toxicity | 20150605 |
EP-3303295-A2 | Analogues of hydroxychloroquine (hcq) without retinal toxicity | 20150605 |
US-10647677-B2 | Analogues of hydroxychloroquine (HCQ) without retinal toxicity | 20150605 |
US-2019062278-A1 | Analogues of hydroxychloroquine (hcq) without retinal toxicity | 20150605 |
WO-2016193503-A2 | Analogues of hydroxychloroquine (hcq) without retinal toxicity | 20150605 |
Complexity: | 188 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 230.940932 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 230.940932 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.2 |
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