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36023-06-0 | 8-Bromo-7-methoxyquinoline
CAS No: 36023-06-0 Catalog No: AG003NHY MDL No:MFCD16619426
Product Description
Catalog Number:
AG003NHY
Chemical Name:
8-Bromo-7-methoxyquinoline
CAS Number:
36023-06-0
Molecular Formula:
C10H8BrNO
Molecular Weight:
238.0806
MDL Number:
MFCD16619426
IUPAC Name:
8-bromo-7-methoxyquinoline
InChI:
InChI=1S/C10H8BrNO/c1-13-8-5-4-7-3-2-6-12-10(7)9(8)11/h2-6H,1H3
InChI Key:
PYLZPPOBCRUWJX-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1Br)nccc2
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.979g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.084g/mol
Monoisotopic Mass:
236.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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