Home Halogens Acetic acid,2-(2-bromo-4-chlorophenoxy)-

Acetic acid,2-(2-bromo-4-chlorophenoxy)-

CAS No.:
77228-66-1
Catalog Number:
AG005ON1
Molecular Formula:
C8H6BrClO3
Molecular Weight:
265.4884
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Product Description
Catalog Number:
AG005ON1
Chemical Name:
Acetic acid,2-(2-bromo-4-chlorophenoxy)-
CAS Number:
77228-66-1
Molecular Formula:
C8H6BrClO3
Molecular Weight:
265.4884
MDL Number:
MFCD03613709
IUPAC Name:
2-(2-bromo-4-chlorophenoxy)acetic acid
InChI:
InChI=1S/C8H6BrClO3/c9-6-3-5(10)1-2-7(6)13-4-8(11)12/h1-3H,4H2,(H,11,12)
InChI Key:
IQFPVGBBDOCAMI-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc(cc1Br)Cl
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.919g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
265.487g/mol
Monoisotopic Mass:
263.919g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties