4-Bromo-6-methoxy-2-methylquinoline - CAS 856095-00-6
Catalog: |
BB037661 |
Product Name: |
4-Bromo-6-methoxy-2-methylquinoline |
CAS: |
856095-00-6 |
Synonyms: |
4-bromo-6-methoxy-2-methylquinoline |
IUPAC Name: | 4-bromo-6-methoxy-2-methylquinoline |
Description: | 4-Bromo-6-methoxy-2-methylquinoline (CAS# 856095-00-6) is a useful research chemical. |
Molecular Weight: | 252.11 |
Molecular Formula: | C11H10BrNO |
Canonical SMILES: | CC1=NC2=C(C=C(C=C2)OC)C(=C1)Br |
InChI: | InChI=1S/C11H10BrNO/c1-7-5-10(12)9-6-8(14-2)3-4-11(9)13-7/h3-6H,1-2H3 |
InChI Key: | GKOUTMWNNUHDTO-UHFFFAOYSA-N |
Boiling Point: | 341.3 °C at 760 mmHg |
Density: | 1.455 g/cm3 |
LogP: | 3.31430 |
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 |
WO-2021092525-A1 | Wdr5 inhibitors and modulators | 20191108 |
WO-2020247679-A1 | Wdr5 inhibitors and modulators | 20190604 |
EP-3180006-A1 | Substituted quinoline-4-carboxamides and use thereof | 20140814 |
WO-2016023885-A1 | Substituted quinoline-4-carboxamides and use thereof | 20140814 |
AU-2010279337-A1 | Bicyclic aryl sphingosine 1-phosphate analogs | 20090805 |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 250.99458 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 250.99458 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 22.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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Quinoline/Isoquinoline
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