Name: Name:3,3',4,4'-Biphenyltetracarboxylic acid
Brand: Angene
SKU: AG00I4HM
Rating: 90 (10 reviews)

Catalog Number:

AG00I4HM

Chemical Name:

3,3',4,4'-Biphenyltetracarboxylic acid

CAS Number:

22803-05-0

Molecular Formula:

C16H10O8

Molecular Weight:

330.2458

MDL Number:

MFCD00496632

IUPAC Name:

4-(3,4-dicarboxyphenyl)phthalic acid

InChI:

InChI=1S/C16H10O8/c17-13(18)9-3-1-7(5-11(9)15(21)22)8-2-4-10(14(19)20)12(6-8)16(23)24/h1-6H,(H,17,18)(H,19,20)(H,21,22)(H,23,24)

InChI Key:

LFBALUPVVFCEPA-UHFFFAOYSA-N

SMILES:

OC(=O)c1cc(ccc1C(=O)O)c1ccc(c(c1)C(=O)O)C(=O)O

Complexity:

494

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

330.038g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

330.248g/mol

Monoisotopic Mass:

330.038g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

149A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7

Title	Journal
Poly[[aqua-(μ(7)-biphenyl-3,3',4,4'-tetra-carboxyl-ato)(1,10-phenanthroline)dicobalt(II)] monohydrate].	Acta crystallographica. Section E, Structure reports online 20110801
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Poly[(μ4-biphenyl-3,3',4,4'-tetracarboxylato)bis[μ2-1,4-bis(imidazol-1-ylmethyl)benzene]dicobalt(II)].	Acta crystallographica. Section C, Crystal structure communications 20101001
Hexaaqua-cobalt(II) 3,3'-dicarb-oxy-biphenyl-4,4'-dicarboxyl-ate.	Acta crystallographica. Section E, Structure reports online 20100801
4-(4-Pyrid-yl)pyridinium 3',4,4'-tricarboxy-biphenyl-3-carboxyl-ate dihydrate.	Acta crystallographica. Section E, Structure reports online 20100101
Poly[bis-(4,4'-bipyridine)(μ(3)-4,4'-dicarboxybiphenyl-3,3'-di-carboxyl-ato)iron(II)].	Acta crystallographica. Section E, Structure reports online 20091201
μ-Biphenyl-3,3',4,4'-tetra-carboxyl-ato-κO:O-bis-[triaqua-(2,2'-bipyridyl-κN,N')nickel(II)] hexa-hydrate.	Acta crystallographica. Section E, Structure reports online 20090501
Diaqua-bis(2,2'-biimidazole)cobalt(II) 4,4'-dicarboxy-biphenyl-3,3'-di-car-boxylate.	Acta crystallographica. Section E, Structure reports online 20090401
Diaqua-bis(2,2'-biimidazole)zinc(II) 4,4'-di-carboxybiphenyl-3,3'-di-carboxyl-ate.	Acta crystallographica. Section E, Structure reports online 20090401
Biphenyl-3,3',4,4'-tetra-carboxylic acid dihydrate.	Acta crystallographica. Section E, Structure reports online 20090201
Poly[[tetra-aqua-(μ(6)-2,2'-diiodo-biphenyl-4,4',5,5'-tetra-carboxyl-ato)dizinc(II)] dihydrate].	Acta crystallographica. Section E, Structure reports online 20080901
Low pH hydrothermal synthesis and properties of lanthanide-organic frameworks with (4(10),6(5))(4(9),6(6)) topology constructed from Ln-Hbptc building blocks.	Dalton transactions (Cambridge, England : 2003) 20071114
A novel cadmium(II) coordination polymer with biphenyl-3,3',4,4'-tetracarboxylic acid and 4,4'-bipyridine.	Acta crystallographica. Section C, Crystal structure communications 20051101