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80791-78-2 | 2,4-DIHYDROXY-3,5-DIBROMOPYRIDINE
CAS No: 80791-78-2 Catalog No: AG0051EU MDL No:
Product Description
Catalog Number:
AG0051EU
Chemical Name:
2,4-DIHYDROXY-3,5-DIBROMOPYRIDINE
CAS Number:
80791-78-2
Molecular Formula:
C5H3Br2NO2
Molecular Weight:
268.8908
IUPAC Name:
3,5-dibromo-4-hydroxy-1H-pyridin-2-one
InChI:
InChI=1S/C5H3Br2NO2/c6-2-1-8-5(10)3(7)4(2)9/h1H,(H2,8,9,10)
InChI Key:
HKXODMWXBCAVFQ-UHFFFAOYSA-N
SMILES:
Brc1cnc(c(c1O)Br)O
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.851g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
268.892g/mol
Monoisotopic Mass:
266.853g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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