4-Bromo-6-methoxyquinoline - CAS 42881-66-3
Catalog: |
BB025270 |
Product Name: |
4-Bromo-6-methoxyquinoline |
CAS: |
42881-66-3 |
Synonyms: |
4-bromo-6-methoxyquinoline |
IUPAC Name: | 4-bromo-6-methoxyquinoline |
Description: | 4-Bromo-6-methoxyquinoline (CAS# 42881-66-3) is a useful research chemical. |
Molecular Weight: | 238.08 |
Molecular Formula: | C10H8BrNO |
Canonical SMILES: | COC1=CC2=C(C=CN=C2C=C1)Br |
InChI: | InChI=1S/C10H8BrNO/c1-13-7-2-3-10-8(6-7)9(11)4-5-12-10/h2-6H,1H3 |
InChI Key: | HRFFYKLVLCFCQG-UHFFFAOYSA-N |
Boiling Point: | 336.9 ℃ at 760 mmHg |
Purity: | 95 % |
Density: | 1.516 g/cm3 |
MDL: | MFCD08437074 |
LogP: | 3.00590 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021150954-A1 | Bacterial topoisomerase inhibitors derived from isomannide | 20200124 |
WO-2021092525-A1 | Wdr5 inhibitors and modulators | 20191108 |
US-2021147386-A1 | Pyrrolidine and piperidine compounds | 20191106 |
WO-2021090245-A1 | Pyrrolidine and piperidine compounds | 20191106 |
WO-2020247679-A1 | Wdr5 inhibitors and modulators | 20190604 |
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 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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