4-Bromo-8-methoxyquinoline - CAS 103028-31-5
Catalog: |
BB000987 |
Product Name: |
4-Bromo-8-methoxyquinoline |
CAS: |
103028-31-5 |
Synonyms: |
4-bromo-8-methoxyquinoline |
IUPAC Name: | 4-bromo-8-methoxyquinoline |
Description: | 4-Bromo-8-methoxyquinoline (CAS# 103028-31-5) is a useful research chemical. |
Molecular Weight: | 238.08 |
Molecular Formula: | C10H8BrNO |
Canonical SMILES: | COC1=CC=CC2=C(C=CN=C21)Br |
InChI: | InChI=1S/C10H8BrNO/c1-13-9-4-2-3-7-8(11)5-6-12-10(7)9/h2-6H,1H3 |
InChI Key: | ZTCUNVSNCQDTQR-UHFFFAOYSA-N |
Boiling Point: | 336.9 °C at 760 mmHg |
Density: | 1.516 g/cm3 |
MDL: | MFCD08063209 |
LogP: | 3.00590 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-111960998-A | Nitroxoline derivatives, preparation method and application thereof | 20200803 |
US-2021147386-A1 | Pyrrolidine and piperidine compounds | 20191106 |
WO-2021090245-A1 | Pyrrolidine and piperidine compounds | 20191106 |
CN-112300126-A | Heterocyclic DNA-PK inhibitors | 20190731 |
EP-3696170-A1 | 3,6-disubstituted-2-pyridinaldoxime scaffolds | 20190215 |
PMID | Publication Date | Title | Journal |
21202628 | 20080521 | 4-Bromo-8-methoxy-quinoline | Acta crystallographica. Section E, Structure reports online |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 236.97893 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 236.97893 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 22.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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