Di-O-Methylcrenatin

Basic Information

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CAS Number

64121-98-8

Molecular Formula

C15H22O9

Molecular Weight

346.33 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

SMILES

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COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)CO

InChI

InChI=1S/C15H22O9/c1-21-8-3-7(5-16)4-9(22-2)14(8)24-15-13(20)12(19)11(18)10(6-17)23-15/h3-4,10-13,15-20H,5-6H2,1-2H3/t10-,11-,12+,13-,15+/m1/s1

InChIKey

RWIINOLFQCPJMH-VVSAWPALSA-N

LogP

-1.6251999999999995

Topological Polar Surface Area

138.07000000000002 Å²

Hydrogen Bond Donor/Acceptor

5 / 9

Complexity

368

Synonyms & References

English

b-D-Glucopyranoside, 4-(hydroxymethyl)-2,6-dimethoxyphenyl
Di-O-methylcrenatin
2,2'-Disulfanediylbis(5-chlorobenzoyl chloride)
2,6-di-O-methylcrenatin
4-hydroxymethyl-2,6,7-trioxabicyclooctane
beta-D-Glucopyranoside 4-(hydroxymethyl)-2,6-dimethoxyphenyl
CHEBI:68338
CS-0024177
HY-N3763
DTXSID101315734
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]oxane-3,4,5-triol
AKOS040761617
3,5-dimethoxy-4-hydroxybenzyl alcohol-4-O-beta-D-glucopyranoside
Q27136835
64121-98-8
FS-9281
4-(hydroxymethyl)-2,6-dimethoxyphenyl beta-D-glucopyranoside
Di-O-Methylcrenatin
DA-72793
NCGC00385556-01
CHEMBL1923074

MDL Number

MFCD23103681

FAQ

What regulatory guidelines apply to Di-O-Methylcrenatin (CAS: 64121-98-8)?

Di-O-Methylcrenatin (CAS: 64121-98-8) falls under the scope of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) and is subject to regulations such as the REACH (Registration, Evaluation, Authorisation, and Restriction of Chemicals) framework in the European Union. It is also regulated by the U.S. Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) for safety and environmental protection. Manufacturers and importers must ensure compliance with these guidelines, including proper labeling, storage, and handling.

Are there alternatives to Di-O-Methylcrenatin in synthesis (CAS: 64121-98-8)?

Di-O-Methylcrenatin (CAS: 64121-98-8) can have alternatives in synthesis depending on the application. Commonly, chemists might explore isomers or analogs such as mono-O-methyl derivatives or other closely related compounds. Alternative reagents like phenols or other methylating agents can also be considered based on the specific reaction conditions and goals.

What is the market or research trend for Di-O-Methylcrenatin (CAS: 64121-98-8)?

The market for Di-O-Methylcrenatin (CAS: 64121-98-8) is growing with increasing demand across various industries due to its unique chemical properties. Research trends indicate a focus on its application in pharmaceuticals, agrochemicals, and as a precursor in synthesis. The trend is also towards more sustainable and environmentally friendly production methods, aligning with global regulatory and market demands.

How should waste containing Di-O-Methylcrenatin (CAS: 64121-98-8) be handled?

Waste containing Di-O-Methylcrenatin (CAS: 64121-98-8) should be collected and stored in appropriate, leak-proof containers. Proper disposal methods include incineration or professional waste disposal services. Environmental protection precautions include ensuring no spillage and adhering to local and international waste management regulations. Hazardous waste management guidelines must be followed to prevent environmental contamination.