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Home Carboxys Biphenyl-3,3'-dicarboxylic acid

Biphenyl-3,3'-dicarboxylic acid

CAS No.:
612-87-3
Catalog Number:
AG00EJ85
Molecular Formula:
C14H10O4
Molecular Weight:
242.2268
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$75
- +
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$550
- +
Product Description
Catalog Number:
AG00EJ85
Chemical Name:
Biphenyl-3,3'-dicarboxylic acid
CAS Number:
612-87-3
Molecular Formula:
C14H10O4
Molecular Weight:
242.2268
MDL Number:
MFCD00845987
IUPAC Name:
3-(3-carboxyphenyl)benzoic acid
InChI:
InChI=1S/C14H10O4/c15-13(16)11-5-1-3-9(7-11)10-4-2-6-12(8-10)14(17)18/h1-8H,(H,15,16)(H,17,18)
InChI Key:
KHZYMPDILLAIQY-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1)c1cccc(c1)C(=O)O
NSC Number:
78785
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.058g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
242.23g/mol
Monoisotopic Mass:
242.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Poly[(μ(3)-biphenyl-3,3'-dicarboxyl-ato)(1,10-phenanthroline)cadmium]. Acta crystallographica. Section E, Structure reports online 20111101
Biphenyl-3,3'-dicarb-oxy-lic acid. Acta crystallographica. Section E, Structure reports online 20110501
Poly[(μ(4)-biphenyl-3,3'-dicarboxyl-ato)bis[μ(2)-1,1'-(butane-1,4-di-yl)diimidazole](μ(2)-oxalato)dimanganese(II)]. Acta crystallographica. Section E, Structure reports online 20101001
Properties