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Home Other Building Blocks 2-Bromo-6-Carboxy-1-Oxo-1,2-Dihydropyridin-1-Ium

2-Bromo-6-Carboxy-1-Oxo-1,2-Dihydropyridin-1-Ium

CAS No.:
1609646-56-1
Catalog Number:
AG019ELI
Molecular Formula:
C6H5BrNO3+
Molecular Weight:
219.0128
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$200
- +
250mg
95%
In Stock USA
United States
$368
- +
1g
95%
In Stock USA
United States
$735
- +
Product Description
Catalog Number:
AG019ELI
Chemical Name:
2-Bromo-6-Carboxy-1-Oxo-1,2-Dihydropyridin-1-Ium
CAS Number:
1609646-56-1
Molecular Formula:
C6H5BrNO3+
Molecular Weight:
219.0128
MDL Number:
MFCD30471839
IUPAC Name:
2-bromo-1-oxo-2H-pyridin-1-ium-6-carboxylic acid
InChI:
InChI=1S/C6H4BrNO3/c7-5-3-1-2-4(6(9)10)8(5)11/h1-3,5H/p+1
InChI Key:
IWZAAWIFVRILMQ-UHFFFAOYSA-O
SMILES:
OC(=O)C1=CC=CC([N+]1=O)Br
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.945g/mol
Formal Charge:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.014g/mol
Monoisotopic Mass:
217.945g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties