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Home > Bromides > 1222184-73-7
1222184-73-7 | 2,4-Pyridinedicarboxylic acid, 3-bromo-
CAS No: 1222184-73-7 Catalog No: AG0016YC MDL No:
Product Description
Catalog Number:
AG0016YC
Chemical Name:
2,4-Pyridinedicarboxylic acid, 3-bromo-
CAS Number:
1222184-73-7
Molecular Formula:
C7H4BrNO4
Molecular Weight:
246.0150
IUPAC Name:
3-bromopyridine-2,4-dicarboxylic acid
InChI:
InChI=1S/C7H4BrNO4/c8-4-3(6(10)11)1-2-9-5(4)7(12)13/h1-2H,(H,10,11)(H,12,13)
InChI Key:
OMABVJASPNOYSD-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccnc(c1Br)C(=O)O
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.932g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
246.016g/mol
Monoisotopic Mass:
244.932g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
87.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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