Home Halogens 2-amino-5-bromo-3-chlorobenzoic acid

2-amino-5-bromo-3-chlorobenzoic acid

CAS No.:
58026-21-4
Catalog Number:
AG00ELW9
Molecular Formula:
C7H5BrClNO2
Molecular Weight:
250.4771
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Product Description
Catalog Number:
AG00ELW9
Chemical Name:
2-amino-5-bromo-3-chlorobenzoic acid
CAS Number:
58026-21-4
Molecular Formula:
C7H5BrClNO2
Molecular Weight:
250.4771
MDL Number:
MFCD00839522
IUPAC Name:
2-amino-5-bromo-3-chlorobenzoic acid
InChI:
InChI=1S/C7H5BrClNO2/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2H,10H2,(H,11,12)
InChI Key:
WYPQWEYJRBPSKL-UHFFFAOYSA-N
SMILES:
Brc1cc(Cl)c(c(c1)C(=O)O)N
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.919g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
250.476g/mol
Monoisotopic Mass:
248.919g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties