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1,4-Benzodioxane-6-carboxaldehyde, 99%, Thermo Scientific Chemicals

Catalog No. AAA1869606
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5 g
Catalog No. Quantity
AAA1869606 5 g
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Catalog No. AAA1869606

Supplier: Thermo Scientific Chemicals A1869606

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1,4-Benzodioxan-6-carboxaldehyde finds its uses as building block in the synthesis of tetrahydroisoquinolinones, in the preparation of benzofuran analog, a potential inhibitor of CAMP-specific phosphodiesterase type IV, in the synthesis of (5Z)-5-(2,3-dihydro-1,4-benzodioxan-6-ylmethylene)-1-methyl-2-thioxoimidazolidin-4-one. It was screened as a fragment for inhibitors of PDEA using enthalpy arrays and X-ray crystallography. 1,4-Benzodioxane-6-carboxaldehyde have also been used as an intermediate in the synthesis of a new class of Dopamine D3 and D4 receptor antagonists.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
1,4-Benzodioxan-6-carboxaldehyde finds its uses as building block in the synthesis of tetrahydroisoquinolinones, in the preparation of benzofuran analog, a potential inhibitor of CAMP-specific phosphodiesterase type IV, in the synthesis of (5Z)-5-(2,3-dihydro-1,4-benzodioxan-6-ylmethylene)-1-methyl-2-thioxoimidazolidin-4-one. It was screened as a fragment for inhibitors of PDEA using enthalpy arrays and X-ray crystallography. 1,4-Benzodioxane-6-carboxaldehyde have also been used as an intermediate in the synthesis of a new class of Dopamine D3 and D4 receptor antagonists.

Solubility
Solubility in methanol is almost transparent.

Notes
Store away from air, oxidizing agents and bases. Keep the container tightly closed and place it in a cool, dry and well ventilated condition.

Chemical Identifiers

CAS 29668-44-8
Molecular Formula C9H8O3
Molecular Weight (g/mol) 164.16
MDL Number MFCD00010092
InChI Key CWKXDPPQCVWXAG-UHFFFAOYSA-N
Synonym 1,4-benzodioxan-6-carboxaldehyde, 1,4-benzodioxan-6-carbaldehyde, 2,3-dihydrobenzo b 1,4 dioxine-6-carbaldehyde, 1,4-benzodioxane-6-carboxaldehyde, 3,4-ethylenedioxybenzaldehyde, 1,4-benzodioxin-6-carboxaldehyde, 2,3-dihydro, 7-formyl-1,4-benzodioxane, 1,4-benzodioxane-6-aldehyde, 2,3-dihydro-1,4-benzodioxin-6-carbaldehyde, 1,4-benzodioxane-6-carbaldehyde
PubChem CID 248127
IUPAC Name 2,3-dihydro-1,4-benzodioxine-6-carbaldehyde
SMILES C1COC2=C(O1)C=CC(=C2)C=O

Specifications

Melting Point 48°C to 52°C
Boiling Point 104°C to 106°C (15 mmHg)
Flash Point >110°C (230°F)
Quantity 5 g
Sensitivity Air Sensitive
Formula Weight 164.16
Percent Purity 99%
Chemical Name or Material 1,4-Benzodioxane-6-carboxaldehyde
Hazard Category H315-H319-H335
Precautionary Statement P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P362-P501c
EINECSNumber 249-763-3
TSCA No
Recommended Storage Ambient temperatures

RUO – Research Use Only