Chem 4 Chloro 67 Dimethoxyquinoline AlkaliMetal

Compound 279
  CheckMol                        TMF02:r0:m0
MF=C11H10ClNO2 MW=223.66
 15 16  0  3  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118    1.5055   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3173    2.2582   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2703    2.2582   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3291    3.7637   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6229    1.5290   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2585    3.7637   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0470    4.5165   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6346    4.5165   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9284    2.2818   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9402    3.7873   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2340    1.5408   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2457    4.5400   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2457    0.0588   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5513    3.8108   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 01  0  1  0  0
  2  4 02  0  1  0  0
  3  5 01  0  2  0  0
  3  6 02  0  1  0  0
  4  7 01  0  1  0  0
  5  8 01  0  1  0  0
  5  9 02  0  1  0  0
  6 10 01  0  1  0  0
  9 11 01  0  1  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
  7  8 02  0  1  0  0
 10 11 02  0  1  0  0
M  END

4-Chloro-6,7-Dimethoxyquinoline

₹ 0.00 0.00

Chemical Name - 4-Chloro-6,7-Dimethoxyquinoline
Mol Weight - 223.658
Smiles - COc(cc1c(Cl)ccnc1c1)c1OC

Property Name	Property Value
Mol Name	4-Chloro-6,7-Dimethoxyquinoline
Molweight	223.658
Monoisotopic Mass	223.040006
Clogp	2.4416
Clogs	-3.094
H Acceptors	3
Total Surface Area	166.56
Relative Psa	0.18594
Polar Surface Area	31.35
Druglikeness	-1.5976
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.53333
Molecular Flexibility	0.22851
Molecular Complexity	0.77117
Fragments	1
Non H Atoms	15
Non Ch Atoms	4
Electronegative Atoms	4
Rotatable Bonds	2
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
Sp3 Atoms	4
Aromatic Nitrogens	1
Smiles	COc(cc1c(Cl)ccnc1c1)c1OC
InChIKey	InChI=1S/C11H10ClNO2/c1-14-10-5-7-8(12)3-4-13-9(7)6-11(10)15-2/h3-6H,1-2H3
InChI	WRVHQEYBCDPZEU-UHFFFAOYSA-N

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4-Chloro-6,7-Dimethoxyquinoline