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855254-47-6,MFCD15143485
Catalog No.:AA003HDI
855254-47-6 | 2'-Iodo-[1,1'-biphenyl]-3-carboxylic acid
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Purity
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Price(USD)
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100mg
95%
in stock  
$126.00
- +
250mg
95%
in stock  
$250.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HDI
Chemical Name:
2'-Iodo-[1,1'-biphenyl]-3-carboxylic acid
CAS Number:
855254-47-6
Molecular Formula:
C13H9IO2
Molecular Weight:
324.1138
MDL Number:
MFCD15143485
IUPAC Name:
3-(2-iodophenyl)benzoic acid
InChI:
InChI=1S/C13H9IO2/c14-12-7-2-1-6-11(12)9-4-3-5-10(8-9)13(15)16/h1-8H,(H,15,16)
InChI Key:
QLWJXWHADHUTOJ-UHFFFAOYSA-N
SMILES:
Ic1ccccc1c1cccc(c1)C(=O)O
Properties
Computed Properties
 
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.965g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
324.117g/mol
Monoisotopic Mass:
323.965g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  

Synonyms
 
855254-47-6 
2'-Iodo-[1,1'-biphenyl]-3-carboxylic acid 
AJ-114939 
AX8231444 
TR-038010 
2'-Iodo[1,1'-biphenyl]-3-carboxylic acid 
ST24021427 
V8109 
B-4972 
I04-2885 
C13H9IO2 
2-Iodobiphenyl-3-carboxylic acid 
2'-IODOBIPHENYL-3-CARBOXYLIC ACID 
2'-Iodo-[1,1'-biphenyl]-3-carboxylicacid 
ACMC-20a1rl 
CTK5F5167 
DTXSID70681769 
ANW-53215 
MFCD15143485 
ZINC65336915 
AKOS015853908 
Literature
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