Home Halogens 2-amino-4-bromo-5-chloro-3-methoxybenzoic acid

2-amino-4-bromo-5-chloro-3-methoxybenzoic acid

CAS No.:
1446408-04-3
Catalog Number:
AG01BXX4
Molecular Formula:
C8H7BrClNO3
Molecular Weight:
280.5031
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Product Description
Catalog Number:
AG01BXX4
Chemical Name:
2-amino-4-bromo-5-chloro-3-methoxybenzoic acid
CAS Number:
1446408-04-3
Molecular Formula:
C8H7BrClNO3
Molecular Weight:
280.5031
MDL Number:
MFCD28357149
IUPAC Name:
2-amino-4-bromo-5-chloro-3-methoxybenzoic acid
InChI:
InChI=1S/C8H7BrClNO3/c1-14-7-5(9)4(10)2-3(6(7)11)8(12)13/h2H,11H2,1H3,(H,12,13)
InChI Key:
WXLJJMYMMPSVPV-UHFFFAOYSA-N
SMILES:
COc1c(N)c(cc(c1Br)Cl)C(=O)O
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.93g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
280.502g/mol
Monoisotopic Mass:
278.93g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties