Home Other Building Blocks 3-(6-oxo-1,6-dihydropyridin-3-yl)propanoic acid hydrobromide

3-(6-oxo-1,6-dihydropyridin-3-yl)propanoic acid hydrobromide

CAS No.:
1795288-19-5
Catalog Number:
AG01BFKR
Molecular Formula:
C8H10BrNO3
Molecular Weight:
248.0739
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Product Description
Catalog Number:
AG01BFKR
Chemical Name:
3-(6-oxo-1,6-dihydropyridin-3-yl)propanoic acid hydrobromide
CAS Number:
1795288-19-5
Molecular Formula:
C8H10BrNO3
Molecular Weight:
248.0739
MDL Number:
MFCD28118630
IUPAC Name:
3-(6-oxo-1H-pyridin-3-yl)propanoic acid;hydrobromide
InChI:
InChI=1S/C8H9NO3.BrH/c10-7-3-1-6(5-9-7)2-4-8(11)12;/h1,3,5H,2,4H2,(H,9,10)(H,11,12);1H
InChI Key:
CQOGORNCMLWJJR-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1ccc(=O)[nH]c1.Br
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.984g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
248.076g/mol
Monoisotopic Mass:
246.984g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties