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2,6-Dimethoxybenzoic acid

$78

  • Brand : BIOFRON

  • Catalogue Number : BF-D2030

  • Specification : 98%

  • CAS number : 1466-76-8

  • Formula : C9H10O4

  • Molecular Weight : 182.2

  • PUBCHEM ID : 15109

  • Volume : 20mg

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Catalogue Number

BF-D2030

Analysis Method

HPLC,NMR,MS

Specification

98%

Storage

2-8°C

Molecular Weight

182.2

Appearance

Powder

Botanical Source

herbs of Curculigo orchioides.

Structure Type

Phenolics

Category

Standards;Natural Pytochemical;API

SMILES

COC1=C(C(=CC=C1)OC)C(=O)O

Synonyms

2,6-dimethoxybenzioc acid/2,6-Dimethoxybenzoic acid/Benzoic acid,2,6-dimethoxy/Benzoic acid, 2,6-dimethoxy-/2,6-Dimethoxy-benzoesaeure/Benzoic acid,6-dimethoxy/2,6-dimethoxy benzoic acid/2,6-dimethoxylbenzoic acid

IUPAC Name

2,6-dimethoxybenzoic acid

Density

1.2±0.1 g/cm3

Solubility

Flash Point

126.5±15.8 °C

Boiling Point

314.5±22.0 °C at 760 mmHg

Melting Point

185187°C

InChl

InChl Key

WGK Germany

RID/ADR

HS Code Reference

2918990000

Personal Projective Equipment

Correct Usage

For Reference Standard and R&D, Not for Human Use Directly.

Meta Tag

provides coniferyl ferulate(CAS#:1466-76-8) MSDS, density, melting point, boiling point, structure, formula, molecular weight etc. Articles of coniferyl ferulate are included as well.>> amp version: coniferyl ferulate

PMID

23124460

Abstract

Two concomitant polymorphs of the molecular salt formed by 2,6-dimethoxybenzoic acid, C(9)H(10)O(4) (Dmb), with benzamidine, C(7)H(8)N(2) (benzenecarboximidamide, Benzam) from water solution have been identified. Benzamidinidium 2,6-dimethoxybenzoate, C(7)H(9)N(2)(+)·C(9)H(9)O(4)(-) (BenzamH(+)·Dmb(-)), was obtained through protonation at the imino N atom of Benzam as a result of proton transfer from the acidic hydroxy group of Dmb. In the monoclinic polymorph, (I) (space group P2(1)/n), the asymmetric unit consists of two Dmb(-) anions and two monoprotonated BenzamH(+) cations. In the orthorhombic polymorph, (II) (space group P2(1)2(1)2(1)), one Dmb(-) anion and one BenzamH(+) cation constitute the asymmetric unit. In both polymorphic salts, the amidinium fragments and carboxylate groups are completely delocalized. This delocalization favours the aggregation of the molecular components of these acid-base complexes into nonplanar dimers with an R(2)(2)(8) graph-set motif via N(+)-H···O(-) charge-assisted hydrogen bonding. Both the monoclinic and orthorhombic forms exhibit one-dimensional isostructurality, as the crystal structures feature identical hydrogen-bonding motifs consisting of dimers and catemers.

Title

Supramolecular association in proton-transfer adducts containing benzamidinium cations. II. Concomitant polymorphs of the molecular salt of 2,6-dimethoxybenzoic acid with benzamidine.

Author

Irrera S1, Ortaggi G, Portalone G.

Publish date

2012 Nov


Description :

2,6-Dimethoxybenzoic acid is a member of organic compounds known as o-methoxybenzoic acids and derivatives.