Ethyl D-Glucuronide

Basic Information

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CAS Number

17685-04-0

Molecular Formula

C8H14O7

Molecular Weight

222.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

160-161°C

SMILES

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CCO[C@@H]1O[C@H](C(=O)O)[C@H]([C@@H]([C@H]1O)O)O

InChI

InChI=1S/C8H14O7/c1-2-14-8-5(11)3(9)4(10)6(15-8)7(12)13/h3-6,8-11H,2H2,1H3,(H,12,13)/t3-,4-,5+,6-,8+/m0/s1

InChIKey

IWJBVMJWSPZNJH-UQGZVRACSA-N

LogP

-2.084899999999999

Topological Polar Surface Area

116.45000000000002 Å²

Hydrogen Bond Donor/Acceptor

4 / 7

Complexity

231

Safety Information

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Hazard Statement

H225 Highly Flammable liquid and vapor
Flammable liquids

H370 Causes damage to organs
Specific target organ toxicity, single exposure

Synonyms & References

English

Ethyl β-D-Glucuronide
ethyl glucuronide
Ethyl-ß-D-6-glucuronide
Ethyl-β-D-glucuronide
Ethyl -D-glucuronide
ETHYL B-D-GLUCURONIDE
Ethyl--D-6-glucuronide
Ethyl beta-D-Glucuronide
Ethyl-β-D-glucopyranosiduronsaeure
b-D-Glucopyranosiduronic acid, ethyl-
6-Ethoxy-3,4,5-trihydroxy-tetrahydro-pyran-2-carboxylicAcid
BCP28819
(2S,3S,4S,5R)-6-Ethoxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid

MDL Number

MFCD09037574

FAQ

What are the physical and chemical properties of Ethyl D-Glucuronide (CAS: 17685-04-0)?

Ethyl D-Glucuronide (CAS: 17685-04-0) is a crystalline compound with a molecular weight of approximately 278.23 g/mol. It has a low solubility in water but is moderately soluble in organic solvents. It is relatively stable under normal conditions but can undergo hydrolysis in the presence of acid or base. Ethyl D-Glucuronide is used in various applications due to its unique chemical properties.

How is Ethyl D-Glucuronide (CAS: 17685-04-0) typically synthesized?

Ethyl D-Glucuronide (CAS: 17685-04-0) is typically synthesized through the nucleophilic substitution reaction of D-glucuronic acid with ethyl iodide in the presence of a base. This process yields a high selectivity and good yield, making it a common method for industrial production.

What industries use Ethyl D-Glucuronide (CAS: 17685-04-0)?

Ethyl D-Glucuronide (CAS: 17685-04-0) is primarily used in pharmaceuticals for the detection of drug metabolites in biological samples. It is also utilized in the polymer industry for the synthesis of biodegradable polymers and in the manufacturing of sensors for glucose detection.

What precautions should be taken when handling Ethyl D-Glucuronide (CAS: 17685-04-0)?

When handling Ethyl D-Glucuronide (CAS: 17685-04-0), it is important to wear appropriate personal protective equipment (PPE) such as gloves and goggles. Store it in a cool, dry place away from direct sunlight and flammable materials. In case of spill, use appropriate spill cleanup procedures and refer to the safety data sheet (SDS) for detailed information.