Home Halogens 2,6-Dibromo-5-chloronicotinic acid

2,6-Dibromo-5-chloronicotinic acid

CAS No.:
55304-86-4
Catalog Number:
AG00E553
Molecular Formula:
C6H2Br2ClNO2
Molecular Weight:
315.3466
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Product Description
Catalog Number:
AG00E553
Chemical Name:
2,6-Dibromo-5-chloronicotinic acid
CAS Number:
55304-86-4
Molecular Formula:
C6H2Br2ClNO2
Molecular Weight:
315.3466
MDL Number:
MFCD26743442
IUPAC Name:
2,6-dibromo-5-chloropyridine-3-carboxylic acid
InChI:
InChI=1S/C6H2Br2ClNO2/c7-4-2(6(11)12)1-3(9)5(8)10-4/h1H,(H,11,12)
InChI Key:
UZLWUHWZLKEKLW-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(Cl)c(nc1Br)Br
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.812g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
315.345g/mol
Monoisotopic Mass:
312.814g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties