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Home > Bromides > 1823865-17-3
1823865-17-3 | 2-Quinolinecarboxylic acid, 3,7-dibromo-, methyl ester
CAS No: 1823865-17-3 Catalog No: AG0023PT MDL No:
Product Description
Catalog Number:
AG0023PT
Chemical Name:
2-Quinolinecarboxylic acid, 3,7-dibromo-, methyl ester
CAS Number:
1823865-17-3
Molecular Formula:
C11H7Br2NO2
Molecular Weight:
344.9868
IUPAC Name:
methyl 3,7-dibromoquinoline-2-carboxylate
InChI:
InChI=1S/C11H7Br2NO2/c1-16-11(15)10-8(13)4-6-2-3-7(12)5-9(6)14-10/h2-5H,1H3
InChI Key:
FOODNZGYUPHWJS-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc2cc(Br)ccc2cc1Br
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.882g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.99g/mol
Monoisotopic Mass:
342.884g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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