6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol

Basic Information

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CAS Number

498-07-7

Molecular Formula

C6H10O5

Molecular Weight

162.14 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Physical State

Powder

Melting Point

182-184 °C

Boiling Point

383.8°C at 760 mmHg

Water Solubility

Soluble in Ethanol and Water.

Refractive Index

-66.5 ° (C=2, H2O)

Specific Rotation

-66 º (c=1 in H2O)

SMILES

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C1C2C(C(C(C(O1)O2)O)O)O

InChI

InChI=1S/C6H10O5/c7-3-2-1-10-6(11-2)5(9)4(3)8/h2-9H,1H2

InChIKey

TWNIBLMWSKIRAT-UHFFFAOYSA-N

LogP

-2.1757999999999993

Topological Polar Surface Area

79.15 Å²

Hydrogen Bond Donor/Acceptor

3 / 5

Complexity

161

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

1,6-Anhydro-beta-delta-glucose
NSC 46243
6,8-Dioxabicyclo[3.2.1]octane b-D-glucopyranose deriv.
NS00043551
NSC-46243
4PW
1,6-Anhydro-delta-glucose
SCHEMBL195289
Z1198149756
1,6-Anhydro-beta-D-glucose, 99%
D-GLUCOSE, 1,6-ANHYDRO-
T70965
CS-W023160
CHEBI:30997
1,6-Anhydro-beta-D-glucopyranose
Anhydro-delta-mannosan
HY-W050145
A827859
1,6-Anhydro-b-D-glucopyranose
AKOS006281170
1,6-Anhydro-beta-glucopyranose
498-07-7
1,6-Anhydro-D-glucopyranoside
Leucoglucosan
bmse000569
1,6-Anhydroglucose
1,6-Anhydro-D-glucose, United States Pharmacopeia (USP) Reference Standard
CHEMBL3138649
1,6-ANHYDRO-D-GLUCOSE [USP-RS]
Levoglucosan
MFCD00063248

MDL Number

MFCD00137849

Customs Code

29400000

FAQ

What regulatory guidelines apply to 6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol (CAS: 498-07-7)?

6,8-Dioxabicyclo[3.2.1]octane-2,3,4-triol (CAS: 498-07-7) falls under the scope of the Global Harmonized System of Classification and Labelling of Chemicals (GHS), which requires hazard communication labels indicating its flammability and irritant properties. Additionally, it is regulated under the Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) in the European Union, which mandates safety data sheets and risk assessments. In the United States, the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) may have specific regulations regarding its use and disposal.

Are there alternatives to 6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol in synthesis?

There are alternative reagents that can be used in the synthesis of 6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol, such as 1,4-dioxane and 1,4-dihydroxybutane. These alternatives can offer similar functionalities but with potentially different reactivity and solubility properties. The choice of alternative depends on the specific application and desired product characteristics.

What is the market or research trend for 6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol?

The market for 6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol is growing due to its use in pharmaceuticals and cosmetics. Recent research trends focus on its potential applications in drug development, as a precursor for various biologically active compounds, and in the formulation of personal care products. The trend indicates increasing demand for its use in innovative and sustainable product development.

How should waste containing 6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol be handled?

Waste containing 6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol should be collected in appropriate containers and stored separately to prevent spills or leaks. It should be disposed of through incineration or professional waste disposal services that adhere to local and international regulations. Environmental protection measures include ensuring proper containment and following all safety guidelines to prevent exposure and contamination. It is crucial to consult the safety data sheet (SDS) and local regulations for specific disposal procedures.