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855254-47-6

855254-47-6 | 2'-Iodo-[1,1'-biphenyl]-3-carboxylic acid

CAS No: 855254-47-6 Catalog No: AG003HGA MDL No:MFCD15143485

Product Description

Catalog Number:
AG003HGA
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

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  

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