ChemicalBook > CAS DataBase List > 4,5-Dimethoxy-2-nitrobenzoic acid

4,5-Dimethoxy-2-nitrobenzoic acid

Product Name
4,5-Dimethoxy-2-nitrobenzoic acid
CAS No.
4998-07-6
Chemical Name
4,5-Dimethoxy-2-nitrobenzoic acid
Synonyms
6-NITROVERATRIC ACID;4-Nitroveratic acid;RARECHEM AL BO 1523;6-Nitroveratriceacid;4,5-Dimethoxy-2-nitr;6-Nitroveratricacid,99%;6-NITROVERATRIC ACID 99%;4,5-Dimethoxy-2-nitrobenzoic;4,5-dimethoxy-2-nitrobenzoate;3,4-DIMETHOXY-6-NITROBENZOIC ACID
CBNumber
CB7364668
Molecular Formula
C9H9NO6
Formula Weight
227.17
MOL File
4998-07-6.mol
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4,5-Dimethoxy-2-nitrobenzoic acid Property

Melting point:
195-197 °C(lit.)
Boiling point:
368.87°C (rough estimate)
Density 
1.4777 (rough estimate)
refractive index 
1.5800 (estimate)
storage temp. 
Sealed in dry,Room Temperature
solubility 
Acetonitrile (Slightly), DMSO (Slightly), Methanol (Slightly)
form 
Crystalline Powder
pka
2.34±0.25(Predicted)
color 
Yellow
Water Solubility 
Insoluble in water. Soluble in DMSO and methanol. Solubility in hot 1mol/L NaOH (almost transparency).
BRN 
2123903
InChI
InChI=1S/C9H9NO6/c1-15-7-3-5(9(11)12)6(10(13)14)4-8(7)16-2/h3-4H,1-2H3,(H,11,12)
InChIKey
WWCMFGBGMJAJRX-UHFFFAOYSA-N
SMILES
C(O)(=O)C1=CC(OC)=C(OC)C=C1[N+]([O-])=O
CAS DataBase Reference
4998-07-6(CAS DataBase Reference)
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Safety

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
26-37/39
WGK Germany 
3
HS Code 
29189900
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P271Use only outdoors or in a well-ventilated area.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352IF ON SKIN: wash with plenty of soap and water.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
329231
Product name
4,5-Dimethoxy-2-nitrobenzoic acid
Purity
99%
Packaging
5g
Price
$67.1
Updated
2023/06/20
TCI Chemical
Product number
D2628
Product name
4,5-Dimethoxy-2-nitrobenzoic Acid
Purity
>98.0%(GC)(T)
Packaging
5g
Price
$51
Updated
2024/03/01
TCI Chemical
Product number
D2628
Product name
4,5-Dimethoxy-2-nitrobenzoic Acid
Purity
>98.0%(GC)(T)
Packaging
25g
Price
$157
Updated
2024/03/01
Alfa Aesar
Product number
L08510
Product name
4,5-Dimethoxy-2-nitrobenzoic acid, 98%
Packaging
5g
Price
$22.65
Updated
2024/03/01
Alfa Aesar
Product number
L08510
Product name
4,5-Dimethoxy-2-nitrobenzoic acid, 98%
Packaging
25g
Price
$61.65
Updated
2024/03/01
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4,5-Dimethoxy-2-nitrobenzoic acid Chemical Properties,Usage,Production

Chemical Properties

Yellow crystalline powder

Uses

4,5-Dimethoxy-2-nitrobenzoic acid was used in the synthesis of 4,5-dimethoxy-2-nitrobenzamide and 6,7-dimethoxyquinazoline derivatives.

Application

4,5-dimethoxy-2-nitrobenzoic acid in the reaction with organotin oxides/halides yields the organotin carboxylates in anhydrous toluene. The resulting triorganotin carboxylates are one-dimensional polymers that are solid with trigonal bipyramidal geometry, while in solution, they are tetrahedral. Reaction of di-n-butyl tin oxide with 4,5-dimethoxy-2-nitrobenzoic acid yields Tetrabutylbis(4,5-dimethoxy-2-nitro benzoate)Distannoxane Dimer crystallizes as the usual dicarboxylatotetraorganodistannoxane dimer[1-2].

General Description

4,5-Dimethoxy-2-nitrobenzoic acid is a nitroaromatic compound.

Synthesis

In 3,4-dimethoxy-6-nitrobenzaldehyde (10 g)The reaction medium (20 mL of water, 30 mL of methanol)Acetic acid (3.5 mL), 30% hydrogen peroxide (9 mL)Stir well and add sodium chlorite (content 80%, 9g) in water (5mL); Stirring warming to about 50, monitoring the reaction, After the reaction was completed, sodium bisulfite (10.5 g) was added to quench the reaction, The solvent was evaporated to dryness, the product was dissolved in a solution of sodium hydroxide (6g × 10mL)Filtered to remove impurities, the filtrate was added sulfuric acid to pH 1 precipitated product, Filter and dry and obtained product 4,5-Dimethoxy-2-nitrobenzoic acid 10g (93% yield, high-performance liquid chromatography 99.5% purity).

References

[1] Farooq Ali Shah. “Synthesis, Characterization and Crystal Structure of Tetrabutylbis(4,5-dimethoxy-2-nitro benzoato)Distannoxane Dimer.” Journal of Chemical Crystallography 41 9 (2011).
[2] F. A. Shah. “Organotin(IV) complexes of 4,5-dimethoxy-2-nitrobenzoic acid: Synthesis, characterization, and biological activity.” Russian Journal of Coordination Chemistry 35 12 (2009).

4,5-Dimethoxy-2-nitrobenzoic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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4,5-Dimethoxy-2-nitrobenzoic acid Suppliers

TCI AMERICA
Tel
800-4238616
Fax
+1-888-520-1075 / +1-503-283-1987
Email
sales@tciamerica.com
Country
Americas
ProdList
23653
Advantage
75
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View Lastest Price from 4,5-Dimethoxy-2-nitrobenzoic acid manufacturers

Hebei Yanxi Chemical Co., Ltd.
Product
4,5-Dimethoxy-2-nitrobenzoic acid 4998-07-6
Price
US $0.00/kg
Min. Order
1kg
Purity
0.99
Supply Ability
1000kg
Release date
2023-10-11
Henan Fengda Chemical Co., Ltd
Product
4,5-Dimethoxy-2-nitrobenzoic acid 4998-07-6
Price
US $8.00-0.80/kg
Min. Order
1kg
Purity
99%
Supply Ability
g-kg-tons, free sample is available
Release date
2024-04-08
Zibo Shiji Zhonglian Medical Technology Co., Ltd.
Product
4,5-Dimethoxy-2-nitrobenzoic acid 4998-07-6
Price
US $0.00/KG
Min. Order
25KG
Purity
99.5%
Supply Ability
3T/th
Release date
2023-02-09

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