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74668-74-9 | Quinoline,2-chloro-8-methoxy-
CAS No: 74668-74-9 Catalog No: AG005IHG MDL No:MFCD02684171
Product Description
Catalog Number:
AG005IHG
Chemical Name:
Quinoline,2-chloro-8-methoxy-
CAS Number:
74668-74-9
Molecular Formula:
C10H8ClNO
Molecular Weight:
193.6296
MDL Number:
MFCD02684171
IUPAC Name:
2-chloro-8-methoxyquinoline
InChI:
InChI=1S/C10H8ClNO/c1-13-8-4-2-3-7-5-6-9(11)12-10(7)8/h2-6H,1H3
InChI Key:
IYADVMNJDHMUBV-UHFFFAOYSA-N
SMILES:
COc1cccc2c1nc(Cl)cc2
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.029g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.63g/mol
Monoisotopic Mass:
193.029g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22.1A^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 |
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