2-(5-bromo-2-oxopyridin-1-yl)acetic acid


Chemical Name: 2-(5-bromo-2-oxopyridin-1-yl)acetic acid
CAS Number: 872277-46-8
Product Number: AG00H35C(AGN-PC-015XQG)
Synonyms:
MDL No:
Molecular Formula: C7H6BrNO3
Molecular Weight: 232.0314

Identification/Properties


Computed Properties
Molecular Weight:
232.03g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
230.95311g/mol
Monoisotopic Mass:
230.95311g/mol
Topological Polar Surface Area:
57.6Ų
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
282
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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