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2-Methoxy-quinoline-3-carbaldehyde

CAT: 0013-GTR19254361-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19254361-01Size:200 mg
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Description
2-Methoxy-quinoline-3-carbaldehyde , with CAS No. 139549-06-7, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. 2-Methoxy-quinoline-3-carbaldehyde provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
139549-06-7
Product Name Alternative
Compound 139549 06 7, Compound 139549067
Purity
99.34% (May vary between batches)
Smiles
COc1nc2ccccc2cc1C=O
Molecular Formula
C11H9NO2
Molecular Weight
187.198
Storage Conditions
Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

2-Methoxyquinoline-3-carbaldehyde
CAS Number139549-06-7
PubChem CID838868
IUPAC Name2-methoxyquinoline-3-carbaldehyde
Molecular FormulaC11H9NO2
Molecular Weight187.19
XLogP2
Topological Polar Surface Area39.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity207
SMILES
COC1=NC2=CC=CC=C2C=C1C=O
InChI
InChI=1S/C11H9NO2/c1-14-11-9(7-13)6-8-4-2-3-5-10(8)12-11/h2-7H,1H3
InChIKey
HMZDGMVJEGFPHU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Methoxyquinoline-3-carbaldehyde
CAS: 139549-06-7
CID: 838868
Formula: C11H9NO2
MW: 187.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight187.19
XLogP32
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass187.063328530
Monoisotopic Mass187.063328530
Topological Polar Surface Area39.2 Ų
Heavy Atom Count14
Formal Charge0
Complexity207
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
PFA54906-012-Methoxy-quinoline-3-carbaldehyde
269230-012-Chloro-7-methoxy-quinoline-3-carbaldehyde
sc-3082072-Methoxy-7-methyl-quinoline-3-carbaldehyde
sc-3197497-Methoxy-2-piperidin-1-yl-quinoline-3-carbaldehyde
YEA990786-Methoxy-2-oxo-1,2-dihydro-quinoline-3-carbaldehyde
sc-3197487-Methoxy-2-oxo-1,2-dihydro-quinoline-3-carbaldehyde
sc-3078572-Dimethylamino-quinoline-3-carbaldehyde
sc-3079062-Ethoxy-quinoline-3-carbaldehyde
sc-3090082,7-Dimethoxy-quinoline-3-carbaldehyde
sc-3089842,6-Dimethoxy-quinoline-3-carbaldehyde

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