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205114-20-1 | Quinoline, 3-bromo-6-iodo-
CAS No: 205114-20-1 Catalog No: AG0029VC MDL No:MFCD12024485
Product Description
Catalog Number:
AG0029VC
Chemical Name:
Quinoline, 3-bromo-6-iodo-
CAS Number:
205114-20-1
Molecular Formula:
C9H5BrIN
Molecular Weight:
333.9512
MDL Number:
MFCD12024485
IUPAC Name:
3-bromo-6-iodoquinoline
InChI:
InChI=1S/C9H5BrIN/c10-7-3-6-4-8(11)1-2-9(6)12-5-7/h1-5H
InChI Key:
HRDCDOBHQNVETQ-UHFFFAOYSA-N
SMILES:
Ic1ccc2c(c1)cc(cn2)Br
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.865g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.954g/mol
Monoisotopic Mass:
332.865g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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