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6-Chloro-8-methoxyquinoline

CAT: 0013-GTR19254486-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19254486-01Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
6-Chloro-8-methoxyquinoline , with CAS No. 1355066-78-2, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. 6-Chloro-8-methoxyquinoline 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
1355066-78-2
Product Name Alternative
Compound 1355066 78 2, Compound 1355066782
Purity
99.82% (May vary between batches)
Smiles
COc1cc (Cl) cc2cccnc12
Molecular Formula
C10H8ClNO
Molecular Weight
193.63
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

6-Chloro-8-methoxyquinoline
CAS Number1355066-78-2
PubChem CID58042469
IUPAC Name6-chloro-8-methoxyquinoline
Molecular FormulaC10H8ClNO
Molecular Weight193.63
XLogP2.7
Topological Polar Surface Area22.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity176
SMILES
COC1=C2C(=CC(=C1)Cl)C=CC=N2
InChI
InChI=1S/C10H8ClNO/c1-13-9-6-8(11)5-7-3-2-4-12-10(7)9/h2-6H,1H3
InChIKey
AQTPUKCCECLBDV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-Chloro-8-methoxyquinoline
CAS: 1355066-78-2
CID: 58042469
Formula: C10H8ClNO
MW: 193.63
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight193.63
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass193.0294416
Monoisotopic Mass193.0294416
Topological Polar Surface Area22.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity176
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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