4-Bromo-8-chloroquinoline - CAS 927800-40-6
Catalog: |
BB040616 |
Product Name: |
4-Bromo-8-chloroquinoline |
CAS: |
927800-40-6 |
Synonyms: |
4-bromo-8-chloroquinoline |
IUPAC Name: | 4-bromo-8-chloroquinoline |
Description: | 4-Bromo-8-chloroquinoline (CAS# 927800-40-6) is a useful research chemical. |
Molecular Weight: | 242.50 |
Molecular Formula: | C9H5BrClN |
Canonical SMILES: | C1=CC2=C(C=CN=C2C(=C1)Cl)Br |
InChI: | InChI=1S/C9H5BrClN/c10-7-4-5-12-9-6(7)2-1-3-8(9)11/h1-5H |
InChI Key: | IDHOUYADRURUHC-UHFFFAOYSA-N |
Boiling Point: | 331.348 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.673 g/cm3 |
LogP: | 3.65070 |
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 |
US-2021147386-A1 | Pyrrolidine and piperidine compounds | 20191106 |
WO-2021090245-A1 | Pyrrolidine and piperidine compounds | 20191106 |
AU-2018375308-A1 | Pyranopyrazole and pyrazolopyridine immunomodulators for treatment of autoimmune diseases | 20171129 |
WO-2019108565-A1 | Pyranopyrazole and pyrazolopyridine immunomodulators for treatment of autoimmune diseases | 20171129 |
CA-3083938-A1 | Pyranopyrazole and pyrazolopyridine immunomodulators for treatment of autoimmune diseases | 20171129 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.92939 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.92939 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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