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Home Nitriles 2-Chloro-6-methoxyquinoline-3-carbonitrile

2-Chloro-6-methoxyquinoline-3-carbonitrile

CAS No.:
101617-91-8
Catalog Number:
AG0004ZD
Molecular Formula:
C11H7ClN2O
Molecular Weight:
218.6391
Pack Size
Purity
Availability
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Quantity
  
250mg
In Stock USA
United States
$96
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500mg
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$144
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1g
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$221
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2.5g
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$387
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5g
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$603
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10g
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$943
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25g
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$1721
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50g
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$2714
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Product Description
Catalog Number:
AG0004ZD
Chemical Name:
2-Chloro-6-methoxyquinoline-3-carbonitrile
CAS Number:
101617-91-8
Molecular Formula:
C11H7ClN2O
Molecular Weight:
218.6391
MDL Number:
MFCD02740422
IUPAC Name:
2-chloro-6-methoxyquinoline-3-carbonitrile
InChI:
InChI=1S/C11H7ClN2O/c1-15-9-2-3-10-7(5-9)4-8(6-13)11(12)14-10/h2-5H,1H3
InChI Key:
AMFXVCDHDIEGIM-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)cc(c(n2)Cl)C#N
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.025g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.64g/mol
Monoisotopic Mass:
218.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties