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Home > Bromides > 1378254-96-6
1378254-96-6 | 3-Quinolinecarboxylic acid, 4,6-dibromo-
CAS No: 1378254-96-6 Catalog No: AG0013WV MDL No:
Product Description
Catalog Number:
AG0013WV
Chemical Name:
3-Quinolinecarboxylic acid, 4,6-dibromo-
CAS Number:
1378254-96-6
Molecular Formula:
C10H5Br2NO2
Molecular Weight:
330.9602
IUPAC Name:
4,6-dibromoquinoline-3-carboxylic acid
InChI:
InChI=1S/C10H5Br2NO2/c11-5-1-2-8-6(3-5)9(12)7(4-13-8)10(14)15/h1-4H,(H,14,15)
InChI Key:
BOYXRZOXJQFRGK-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(Br)c(cn2)C(=O)O
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.867g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
330.963g/mol
Monoisotopic Mass:
328.869g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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