4-Hydroxy-8-methoxy-2-methylquinoline - CAS 15644-89-0
Catalog: |
BB011222 |
Product Name: |
4-Hydroxy-8-methoxy-2-methylquinoline |
CAS: |
15644-89-0 |
Synonyms: |
8-methoxy-2-methyl-1H-quinolin-4-one |
IUPAC Name: | 8-methoxy-2-methyl-1H-quinolin-4-one |
Description: | 4-Hydroxy-8-methoxy-2-methylquinoline (CAS# 15644-89-0) is a useful research chemical. |
Molecular Weight: | 189.21 |
Molecular Formula: | C11H11NO2 |
Canonical SMILES: | CC1=CC(=O)C2=C(N1)C(=CC=C2)OC |
InChI: | InChI=1S/C11H11NO2/c1-7-6-9(13)8-4-3-5-10(14-2)11(8)12-7/h3-6H,1-2H3,(H,12,13) |
InChI Key: | DJYYBMQABYVSBR-UHFFFAOYSA-N |
Boiling Point: | 324.9 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.153 g/cm3 |
LogP: | 2.25740 |
GHS Hazard Statement: | H302 (97.44%): 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 |
EP-3424906-A1 | Mycobacterium-tubercolosis-thioredoxin reductase inhibitor as antituberculosis drug | 20170704 |
EP-3649110-A1 | Myobacterium tuberculosis-thioredoxin reductase inhibitor as an antitubercular agent | 20170704 |
WO-2019007710-A1 | MYCOBACTERIUM TUBERCOLOSIS THIORODOXIN REDUCTASE INHIBITOR AS ANTITUBERCULOTICUM | 20170704 |
TW-201639833-A | Novel compounds for the treatment of cancer | 20150507 |
TW-I609013-B | Novel compounds for the treatment of cancer | 20150507 |
Complexity: | 273 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.078978594 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.078978594 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 38.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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Quinoline/Isoquinoline
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