Home Halogens 2-(3-bromo-5-iodophenyl)acetic acid

2-(3-bromo-5-iodophenyl)acetic acid

CAS No.:
1261601-75-5
Catalog Number:
AG01C4O0
Molecular Formula:
C8H6BrIO2
Molecular Weight:
340.9405
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Product Description
Catalog Number:
AG01C4O0
Chemical Name:
2-(3-bromo-5-iodophenyl)acetic acid
CAS Number:
1261601-75-5
Molecular Formula:
C8H6BrIO2
Molecular Weight:
340.9405
MDL Number:
MFCD18391765
IUPAC Name:
2-(3-bromo-5-iodophenyl)acetic acid
InChI:
InChI=1S/C8H6BrIO2/c9-6-1-5(3-8(11)12)2-7(10)4-6/h1-2,4H,3H2,(H,11,12)
InChI Key:
AKOOGDIJKZRNFI-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cc(Br)cc(c1)I
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.86g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
340.942g/mol
Monoisotopic Mass:
339.86g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties