ChemicalBook > CAS DataBase List > 2,3-Dihydro-1,4-benzodioxine-5-carboxylic acid

2,3-Dihydro-1,4-benzodioxine-5-carboxylic acid

Product Name
2,3-Dihydro-1,4-benzodioxine-5-carboxylic acid
CAS No.
4442-53-9
Chemical Name
2,3-Dihydro-1,4-benzodioxine-5-carboxylic acid
Synonyms
2,3-dihydrobenzo[b][1,4]dioxine-5-carboxylic acid;2,3-DIHYDRO-BENZO[1,4]DIOXINE-5-CARBOXYLIC ACID;4-(2;3-Dihydro-1;AKOS BBS-00002750;2,3-Dihydro-1,4-benz;5-CARBOXY-1,4-BENZODIOXANE;Compound 3344 hydrochloride;2,3-Ethylenedioxybenzoic Acid;4-benzodioxine-5-carboxylic acid
CBNumber
CB2467643
Molecular Formula
C9H8O4
Formula Weight
180.16
MOL File
4442-53-9.mol
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2,3-Dihydro-1,4-benzodioxine-5-carboxylic acid Property

Melting point:
90-94 °C(lit.)
Boiling point:
334.1±41.0 °C(Predicted)
Density 
1.376±0.06 g/cm3(Predicted)
storage temp. 
Sealed in dry,Room Temperature
form 
powder to crystal
pka
4.09±0.20(Predicted)
color 
Light yellow to Brown
InChIKey
VCLSWKVAHAJSFL-UHFFFAOYSA-N
CAS DataBase Reference
4442-53-9(CAS DataBase Reference)
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Safety

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
26-36-37/39-36/37/38
WGK Germany 
3
Hazard Note 
Irritant
HS Code 
29329900
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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.

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

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
563331
Product name
1,4-Benzodioxan-5-carboxylic acid
Purity
98%
Packaging
5g
Price
$69.2
Updated
2023/06/20
TCI Chemical
Product number
B3864
Product name
1,4-Benzodioxane-5-carboxylic Acid
Purity
>98.0%(GC)(T)
Packaging
5g
Price
$49
Updated
2025/07/31
TCI Chemical
Product number
B3864
Product name
1,4-Benzodioxane-5-carboxylic Acid
Purity
>98.0%(GC)(T)
Packaging
25g
Price
$194
Updated
2025/07/31
TRC
Product number
B203528
Product name
1,4-Benzodioxan-5-carboxylic acid
Packaging
1g
Price
$75
Updated
2021/12/16
AK Scientific
Product number
J51803
Product name
1,4-Benzodioxan-5-carboxylic acid
Packaging
1g
Price
$10
Updated
2021/12/16
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2,3-Dihydro-1,4-benzodioxine-5-carboxylic acid Chemical Properties,Usage,Production

Chemical Properties

white to light yellow crystal powder

Synthesis

29668-43-7

4442-53-9

The general procedure for the synthesis of 2,3-dihydro-1,4-benzodioxane-5-carboxylic acid from 2,3-dihydrobenzo[b][1,4]dioxane-5-carboxaldehyde was as follows: 2,3-dihydrobenzo[b][1,4]dioxane-5-carboxaldehyde (0.500 g, 3.04 mmol) was dissolved in acetone (10 mL) and mixed with an aqueous solution of sulfamic acid at 0-5 °C ( 0.455 g, 4.5 mmol) was mixed and stirred. After the reaction mixture was stirred for 20 minutes, aqueous sodium chlorite (0.421 g, 4.5 mmol) was added and the reaction was continued for 18 hours at room temperature. After completion of the reaction, the reaction mixture was concentrated under reduced pressure and quenched with water. The resulting solid was collected by filtration and dried under vacuum to afford the target product 2,3-dihydro-1,4-benzodioxane-5-carboxylic acid (0.332 g). The product was characterized as follows: 1H NMR (DMSO-d6): δ 4.27 (s, 4H), 6.84 (t, J = 7.2 Hz, 1H), 7.02 (d, J = 7.8 Hz, 1H), 7.20 (d, J = 7.5 Hz, 1H), 12.5 (bs, 1H); MS [M + H]+: 181.12.

References

[1] Patent: WO2013/153535, 2013, A1. Location in patent: Page/Page column 63

2,3-Dihydro-1,4-benzodioxine-5-carboxylic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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2,3-Dihydro-1,4-benzodioxine-5-carboxylic acid Suppliers

TOKYO CHEMICAL INDUSTRY CO., LTD.
Tel
03-36680489
Fax
03-3668-0520
Email
Sales-JP@TCIchemicals.com
Country
Japan
ProdList
28387
Advantage
80
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View Lastest Price from 2,3-Dihydro-1,4-benzodioxine-5-carboxylic acid manufacturers

Career Henan Chemical Co
Product
2,3-Dihydro-1,4-benzodioxine-5-carboxylic acid 4442-53-9
Price
US $1.00/kg
Min. Order
1kg
Purity
95%-99%
Supply Ability
as request
Release date
2018-12-24

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