Home Halogens 4-bromo-2-chloro-6-nitrobenzoic acid

4-bromo-2-chloro-6-nitrobenzoic acid

CAS No.:
2092792-27-1
Catalog Number:
AG01ELK8
Molecular Formula:
C7H3BrClNO4
Molecular Weight:
280.4600
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Product Description
Catalog Number:
AG01ELK8
Chemical Name:
4-bromo-2-chloro-6-nitrobenzoic acid
CAS Number:
2092792-27-1
Molecular Formula:
C7H3BrClNO4
Molecular Weight:
280.4600
MDL Number:
MFCD31667350
IUPAC Name:
4-bromo-2-chloro-6-nitrobenzoic acid
InChI:
InChI=1S/C7H3BrClNO4/c8-3-1-4(9)6(7(11)12)5(2-3)10(13)14/h1-2H,(H,11,12)
InChI Key:
BHVKGDUOOHBRMZ-UHFFFAOYSA-N
SMILES:
Brc1cc(Cl)c(c(c1)[N+](=O)[O-])C(=O)O
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.893g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
280.458g/mol
Monoisotopic Mass:
278.893g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties