4,4'-Biphenyldicarboxylic acid

Product Information

Molecular Formula:
C14H10O4
Molecular Weight:
242.23
Description
Dendrimer building block.
Synonyms
4-(4-carboxyphenyl)benzoic acid; 4-(4-carboxyphenyl)benzoic acid
IUPAC Name
4-(4-carboxyphenyl)benzoic acid
Canonical SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)O)C(=O)O
InChI
InChI=1S/C14H10O4/c15-13(16)11-5-1-9(2-6-11)10-3-7-12(8-4-10)14(17)18/h1-8H,(H,15,16)(H,17,18)
InChI Key
NEQFBGHQPUXOFH-UHFFFAOYSA-N
Boiling Point
482.5±38.0 ℃ (Predicted)
Melting Point
283 ℃ (dec.)
Purity
> 97.0 % (T)
Density
1.347±0.06 g/cm3(Predicted)
Appearance
White to light yellow to light orange powder to crystaline
Application
Used as an intermediate.
LogP
2.75000

Safety Information

Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning

Computed Properties

XLogP3
3.4
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
3
Exact Mass
242.05790880 g/mol
Monoisotopic Mass
242.05790880 g/mol
Topological Polar Surface Area
74.6Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
278
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
CN-114106825-A Sulfur-phosphorus co-doped carbon point @ Zr-MOFs based on sesame straw and preparation method and application thereof 2021-12-17
CN-114085385-A Preparation method of modified metal organic framework for removing impurities in hydrogen storage material 2021-12-02
CN-114086189-A Environment-friendly stainless steel pickling passivation solution 2021-11-24
CN-114163641-A Ammonium polybenzimidazole and alkaline ion exchange membrane thereof, and preparation method and application of ionomer 2021-11-12
CN-113861962-A Ratiometric fluorescent probe, preparation method thereof and application thereof in detection of hydrogen peroxide 2021-11-01
CN-113683532-A Preparation method of citronellonitrile and catalyst adopted by same 2021-10-27
CN-113683532-B Preparation method of citronellonitrile and catalyst adopted by same 2021-10-27
CN-113817158-A Preparation method of high-temperature-resistant nylon resin 2021-10-26
CN-113896901-A Lead halide-based metal organic framework material, preparation and application thereof, ammonia gas sensor and intelligent sensing device 2021-10-25
CN-114044913-A Metal-organic framework material and preparation method thereof 2021-10-25

Literatures

PMID Publication Date Title Journal
22946624 2012-09-17 Tuning structural topologies of three photoluminescent metal-organic frameworks via isomeric biphenyldicarboxylates Inorganic chemistry
22899097 2012-09-05 Molecular self-assembly on an insulating surface: interplay between substrate templating and intermolecular interactions Journal of physics. Condensed matter : an Institute of Physics journal
22524410 2012-05-07 Triple framework interpenetration and immobilization of open metal sites within a microporous mixed metal-organic framework for highly selective gas adsorption Inorganic chemistry
22228032 2012-04-14 Entangled coordination polymers with mixed N- and O-donor organic linkers: a case of module-matching priority Dalton transactions (Cambridge, England : 2003)
22187720 2012-02-07 H2 storage in isostructural UiO-67 and UiO-66 MOFs Physical chemistry chemical physics : PCCP
22220923 2012-02-06 Series of metal organic frameworks assembled from Ln(III), Na(I), and chiral flexible-achiral rigid dicarboxylates exhibiting tunable UV-vis-IR light emission Inorganic chemistry
21973224 2011-12-06 Effect of time, temperature, and kinetics on the hysteretic adsorption-desorption of H2, Ar, and N2 in the metal-organic framework Zn2(bpdc)2(bpee) Langmuir : the ACS journal of surfaces and colloids
21974551 2011-09-28 A low energy electron microscopy study of the initial growth, structure, and thermal stability of 4,4'-biphenyldicarboxylic acid domains on Cu(001) The Journal of chemical physics
21736366 2011-08-17 Understanding the preferential adsorption of CO2 over N2 in a flexible metal-organic framework Journal of the American Chemical Society
21547962 2011-06-06 Modulated synthesis of Zr-based metal-organic frameworks: from nano to single crystals Chemistry (Weinheim an der Bergstrasse, Germany)
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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