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Home > Bromides > 1150561-81-1
1150561-81-1 | 3-Pyridinecarboxylic acid, 2-bromo-4-hydroxy-
CAS No: 1150561-81-1 Catalog No: AG000FSK MDL No:MFCD12026106
Product Description
Catalog Number:
AG000FSK
Chemical Name:
3-Pyridinecarboxylic acid, 2-bromo-4-hydroxy-
CAS Number:
1150561-81-1
Molecular Formula:
C6H4BrNO3
Molecular Weight:
218.0049
MDL Number:
MFCD12026106
IUPAC Name:
2-bromo-4-oxo-1H-pyridine-3-carboxylic acid
InChI:
InChI=1S/C6H4BrNO3/c7-5-4(6(10)11)3(9)1-2-8-5/h1-2H,(H,8,9)(H,10,11)
InChI Key:
KOXXROVSDNRBCY-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(O)ccnc1Br
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.937g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
218.006g/mol
Monoisotopic Mass:
216.937g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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