Cas no 22013-33-8 (2,3-dihydro-1,4-benzodioxin-6-amine)
2,3-dihydro-1,4-benzodioxin-6-amine Chemical and Physical Properties
Names and Identifiers
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- 2,3-Dihydrobenzo[b][1,4]dioxin-6-amine
- 6-Amino-1,4-benzodioxane~1,4-Benzodioxan-6-amine
- 1,4-benzodioxan-6-ylamine
- 3,4-Ethylenedioxyaniline
- 6-Amino-1,4-benzodioxan
- 2,3-Dihydro-1,4-benzodioxin-6-amine
- 6-Amino-1,4-benzodioxane
- AKOS AUF02030
- 3,4-ETHYLENDIOXYANILINE
- 1,4-Benzodioxan-6-Amine
- (3,4-Ethylenedioxy)aniline
- 2,3-dihydro-1,4-benzodioxin-6-amin
- 6-amino-2,3-dihydro-1,4-benzodioxin
- 1,4-Benzodioxin-6-amine, 2,3-dihydro-
- BZKOZYWGZKRTIB-UHFFFAOYSA-N
- 2,3-dihydro-benzo[1,4]dioxin-6-ylamine
- 1,4 Benzodioxan-6-amine
- 1,4-benzodio
- F2190-0470
- 22013-33-8
- NS00027024
- AKOS000112549
- 6-amino-2,3-dihydrobenzo[1,4]dioxin
- 1,4-Benzodioxan-6-amine, >=98%
- 2,3-dihydrobenzo[b]1,4-dioxin-6-amine
- AS-15767
- Oprea1_691270
- SCHEMBL159592
- 6-amino-2,3-dihydro-benzo[1,4]dioxine
- BDBM626145
- InChI=1/C8H9NO2/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-2,5H,3-4,9H
- DTXSID50176461
- SDCCGMLS-0066218.P001
- 1,4-benzodioxane-6-amine
- BB 0221252
- CS-W001112
- MFCD00006824
- EN300-33892
- FT-0606771
- 2,3-dihydrobenzo[1,4]dioxin-6-ylamine
- EINECS 244-718-4
- AC-9464
- 2,3-Dihydro-1,4-benzodioxin-6-amine #
- AM61396
- E0385
- DB-013766
- A10291
- ALBB-032933
- STL168977
- 2,3-dihydro-1,4-benzodioxin-6-amine
-
- MDL: MFCD00006824
- Inchi: 1S/C8H9NO2/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-2,5H,3-4,9H2
- InChI Key: BZKOZYWGZKRTIB-UHFFFAOYSA-N
- SMILES: O1CCOC2C=CC(=CC1=2)N
- BRN: 6447
Computed Properties
- Exact Mass: 151.06300
- Monoisotopic Mass: 151.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 140
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 0.8
- Topological Polar Surface Area: 44.5
Experimental Properties
- Color/Form: Undetermined 2. density (g/ml, 25/4 ℃)
- Density: 1.231?g/mL(lit.)
- Melting Point: 29-31?°C (lit.)
- Boiling Point: 162°C/9mmHg
- Flash Point: Degrees Fahrenheit:235.4°F
Degrees Celsius:113°C - Refractive Index: n20/D 1.599(lit.)
- Water Partition Coefficient: Insoluble
- PSA: 44.48000
- LogP: 1.62120
- Sensitiveness: Light Sensitive
2,3-dihydro-1,4-benzodioxin-6-amine Security Information
-
Symbol:
- Prompt:warning
- Signal Word:Warning
- Hazard Statement: H302+H312+H332-H315-H319
- Warning Statement: P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501
- Hazardous Material transportation number:2810
- WGK Germany:3
- Hazard Category Code: 20/21/22-36/37/38
- Safety Instruction: S26-S37/39-S36/37
-
Hazardous Material Identification:
- HazardClass:6.1
- PackingGroup:III
- Storage Condition:Store long-term at 2-8°C
- Risk Phrases:R20/21/22; R38
- Packing Group:III
- Safety Term:6.1
- Packing Group:III
- Hazard Level:6.1
2,3-dihydro-1,4-benzodioxin-6-amine Customs Data
- HS CODE:29329995
- Customs Data:
China Customs Code:
2932999099Overview:
2932999099. Other heterocyclic compounds containing only oxygen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to
Summary:
2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
2,3-dihydro-1,4-benzodioxin-6-amine Pricemore >>
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| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | 193232-10G |
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2,3-dihydro-1,4-benzodioxin-6-amine Suppliers
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Additional information on 2,3-dihydro-1,4-benzodioxin-6-amine
Comprehensive Overview of 2,3-Dihydro-1,4-benzodioxin-6-amine (CAS No. 22013-33-8)
2,3-Dihydro-1,4-benzodioxin-6-amine (CAS No. 22013-33-8) is a heterocyclic organic compound with a benzodioxin core structure. This compound has garnered significant attention in pharmaceutical and agrochemical research due to its versatile applications. The benzodioxin scaffold is known for its stability and bioactivity, making it a valuable building block in drug discovery. Researchers often explore derivatives of this compound for potential therapeutic properties, including anti-inflammatory and antioxidant effects.
In recent years, the demand for 2,3-dihydro-1,4-benzodioxin-6-amine has increased, particularly in the development of novel small-molecule drugs. Its unique structure allows for modifications that enhance binding affinity to biological targets. For instance, studies have investigated its role in modulating enzyme activity and receptor interactions, which are critical in treating metabolic disorders. The compound's amine functional group further enables its use in synthesizing more complex molecules, such as heterocyclic amines with improved pharmacokinetic profiles.
From an industrial perspective, CAS No. 22013-33-8 is often utilized in the synthesis of specialty chemicals and fine chemicals. Its applications extend to materials science, where it serves as a precursor for functional polymers and coatings. The compound's thermal stability and solubility in organic solvents make it suitable for high-performance material formulations. Additionally, its eco-friendly potential has been explored in green chemistry initiatives, aligning with global trends toward sustainable manufacturing.
One of the most frequently searched questions about 2,3-dihydro-1,4-benzodioxin-6-amine revolves around its synthetic routes. Common methods include Pd-catalyzed coupling reactions and reductive amination of corresponding ketones. Researchers also inquire about its spectroscopic properties, such as NMR and IR spectra, which are essential for quality control in production. The compound's melting point and solubility data are equally critical for laboratory and industrial applications.
In the context of drug discovery, 2,3-dihydro-1,4-benzodioxin-6-amine is often compared to other benzodioxin derivatives due to its balanced lipophilicity and bioavailability. Its potential as a central nervous system (CNS) agent has been a topic of interest, particularly in neurodegenerative disease research. The compound's ability to cross the blood-brain barrier makes it a candidate for developing neuroprotective drugs. However, further clinical studies are needed to validate its efficacy and safety.
Another trending topic is the computational modeling of 2,3-dihydro-1,4-benzodioxin-6-amine and its interactions with biological targets. Molecular docking studies have provided insights into its binding modes, which are crucial for rational drug design. The compound's QSAR (Quantitative Structure-Activity Relationship) parameters are also frequently analyzed to predict its biological activity. These computational approaches reduce experimental costs and accelerate the discovery of new therapeutics.
Environmental and regulatory aspects of CAS No. 22013-33-8 are also noteworthy. While the compound is not classified as hazardous, proper handling and disposal protocols are recommended to minimize environmental impact. Regulatory bodies such as the EPA and REACH have guidelines for its use in industrial settings. Companies are increasingly adopting green synthesis methods to produce this compound, reflecting the growing emphasis on sustainable chemistry.
In summary, 2,3-dihydro-1,4-benzodioxin-6-amine (CAS No. 22013-33-8) is a multifaceted compound with broad applications in pharmaceuticals, agrochemicals, and materials science. Its benzodioxin core and amine functionality make it a valuable intermediate in synthetic chemistry. As research continues to uncover its potential, this compound remains a focal point in the development of innovative and sustainable solutions across multiple industries.
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