2,6-Naphthalenedicarboxylic acid
Product Information
Molecular Formula
C12H8O4
Molecular Weight
216.19
Description
Naphthalenedicarboxylic acid (H2ndc) can be used in the formation of metal-organic coordination polymers (MOCPs) for potential applications in various fields such as adsorption, separation, and magnetism. It can also be used as a monomer in the production of polyesters. H2ndc can also be used in the synthesis of a metal-organic framework (MOF), which can further be used as a drug carrier.
Synonyms
naphthalene-2,6-dicarboxylic acid
IUPAC Name
naphthalene-2,6-dicarboxylic acid
SMILES
C1=CC2=C(C=CC(=C2)C(=O)O)C=C1C(=O)O
InChI
InChI=1S/C12H8O4/c13-11(14)9-3-1-7-5-10(12(15)16)4-2-8(7)6-9/h1-6H,(H,13,14)(H,15,16)
InChI Key
RXOHFPCZGPKIRD-UHFFFAOYSA-N
Melting Point
> 300 °C
Flash Point
Not applicable
Purity
95 %
Density
1.5 g/cm3
Appearance
Beige powder
Storage
Store under inert gas, 2-8 °C
LogP
2.23620
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362
Signal Word
Warning
Computed Properties
XLogP3
2.8
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
216.04225873 g/mol
Monoisotopic Mass
216.04225873 g/mol
Topological Polar Surface Area
74.6Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
269
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 |
|---|---|---|
| US-10934384-B1 | Polyurethane elastomer compositions, and processes thereof | 2020-09-09 |
| US-10934385-B1 | Polyurethane elastomers, bio-additive foam compositions | 2020-09-09 |
| US-2021187884-A1 | Liquid crystal polymer film and laminate comprising the same | 2019-12-23 |
| US-2021189059-A1 | Laminate, circuit board, and liquid crystal polymer film applied to the same | 2019-12-23 |
| US-2021189075-A1 | Liquid crystal polymer film and laminate comprising the same | 2019-12-23 |
| US-2021189118-A1 | Liquid crystal polymer film and laminate comprising the same | 2019-12-23 |
| US-2021189242-A1 | Liquid crystal polymer film and laminate comprising the same | 2019-12-23 |
| WO-2021123655-A1 | Method for manufacturing a polyester containing at least one 1,4:3,6-dianhydrohexitol unit with reduced colouring and improved rates of incorporation of the unit(s) | 2019-12-20 |
| WO-2021124908-A1 | Resin composition for aqueous ink | 2019-12-20 |
| WO-2021125236-A1 | Biaxially oriented polyester film and method for producing same | 2019-12-20 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22930156 | 2012-10-11 | Non-interpenetrated IRMOF-8: synthesis, activation, and gas sorption | Chemical communications (Cambridge, England) |
| 22717946 | 2012-09-21 | Coordination polymers containing rotaxane linkers | Chemical Society reviews |
| 22897859 | 2012-09-21 | Size-exclusion chromatography of poly(ethylene 2,6-naphthalate) | Journal of chromatography. A |
| 22615161 | 2012-06-18 | Neutral and anionic guests and their effect on the formation of pseudorotaxanes by using a flexible tetracationic imidazolium macrocycle | Chemistry (Weinheim an der Bergstrasse, Germany) |
| 22273680 | 2012-01-24 | Geometry analysis and systematic synthesis of highly porous isoreticular frameworks with a unique topology | Nature communications |
| 22148730 | 2012-01-02 | Selective CO2 adsorption in a robust and water-stable porous coordination polymer with new network topology | Inorganic chemistry |
| 22168395 | 2012-01-02 | Water-free neodymium 2,6-naphthalenedicarboxylates coordination complexes and their application as catalysts for isoprene polymerization | Inorganic chemistry |
| 21539397 | 2011-06-08 | High-pressure in situ 129Xe NMR spectroscopy and computer simulations of breathing transitions in the metal-organic framework Ni2(2,6-ndc)2(dabco) (DUT-8(Ni)) | Journal of the American Chemical Society |
| 21394353 | 2011-04-28 | The first porous MOF with photoswitchable linker molecules | Dalton transactions (Cambridge, England : 2003) |
| 21103564 | 2011-03-14 | Microporous sensor: gas sorption, guest exchange and guest-dependant luminescence of metal-organic framework | Dalton transactions (Cambridge, England : 2003) |
