[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl (2R)-4-hydroxy-3-(4-hydroxyphenyl)-2-methyl-5-oxofuran-2-carboxylate

Basic Information

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CAS Number

87414-49-1

Molecular Formula

C24H24O7

Molecular Weight

424.45 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

74℃

Boiling Point

660.1±55.0 °C(Predicted)

Density

1.353±0.06 g/cm3(Predicted)

Solubility

Soluble in ethanol at 25mg/ml or DMSO at 10mg/ml

SMILES

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CC(C)=CCC1=C(O)C=CC(COC(=O)[C@]2(C)OC(=O)C(O)=C2C2=CC=C(O)C=C2)=C1

InChI

InChI=1S/C24H24O7/c1-14(2)4-6-17-12-15(5-11-19(17)26)13-30-23(29)24(3)20(21(27)22(28)31-24)16-7-9-18(25)10-8-16/h4-5,7-12,25-27H,6,13H2,1-3H3/t24-/m1/s1

InChIKey

FPVUCBMBMUHRDX-XMMPIXPASA-N

LogP

3.9345000000000026

pKa

8.59±0.40(Predicted)

Topological Polar Surface Area

113.29000000000002 Å²

Hydrogen Bond Donor/Acceptor

3 / 7

Complexity

743

Safety Information

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Storage Conditions

Store at -20°C

Sensitiveness

Light Sensitive

RTECS

LU0221600

Synonyms & References

English

[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl (2R)-4-hydroxy-3-(4-hydroxyphenyl)-2-methyl-5-oxofuran-2-carboxylate
BUTYROLACTONE I
olomoucin
2-Furancarboxylic acid, 2,5-dihydro-4-hydroxy-2-[[4-hydroxy-3-(3-methyl-2-butenyl)phenyl]methyl]-3-(4-hydroxyphenyl)-5-oxo-, methyl ester, (2R)- (9CI)
4′-O-Demethylversicolactone D
Butyrolactone I
Olomoucin
QF-1
2,5-Dihydro-4-hydroxy-2-[4-hydroxy-3-(3-methyl-2-butenyl)benzyl]-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylic acid methyl ester
OloMoucin
2-Furancarboxylic acid, 2,5-dihydro-4-hydroxy-2-[[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]methyl]-3-(4-hydroxyphenyl)-5-oxo-, methyl ester, (2R)-
Butyrolactone I - CAS 87414-49-1

MDL Number

MFCD03453074

Customs Code

29419000

FAQ

What is [4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl (2R)-4-hydroxy-3-(4-hydroxyphenyl)-2-methyl-5-oxofuran-2-carboxylate (CAS: 87414-49-1)?

This compound is a complex organic molecule with a furan ring and hydroxyl groups. It is primarily used in pharmaceutical and research applications. The compound's structure includes a phenolic group, a furan ring, and a hydroxyl-substituted alkene. It is a key intermediate in the synthesis of various bioactive compounds and is used in studies related to drug development and chemical synthesis.

What are the main uses of [4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl (2R)-4-hydroxy-3-(4-hydroxyphenyl)-2-methyl-5-oxofuran-2-carboxylate (CAS: 87414-49-1)?

This compound is mainly used as an intermediate in the synthesis of pharmaceuticals and bioactive compounds. It is also utilized in research for developing new drug candidates and in academic studies focusing on chemical synthesis and organic chemistry.

Is [4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl (2R)-4-hydroxy-3-(4-hydroxyphenyl)-2-methyl-5-oxofuran-2-carboxylate (CAS: 87414-49-1) safe?

This compound is generally safe when handled with proper precautions. It is important to follow recommended safety guidelines, including wearing appropriate personal protective equipment, such as gloves and safety goggles, and ensuring good ventilation during handling. Storage should be in a secure, dry, and cool place, away from direct sunlight and sources of ignition.

How should [4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl (2R)-4-hydroxy-3-(4-hydroxyphenyl)-2-methyl-5-oxofuran-2-carboxylate (CAS: 87414-49-1) be stored?

This compound should be stored in a cool, dry place, protected from light and heat. It should be kept in a tightly sealed container to prevent exposure to moisture and air. The storage area should be well-ventilated and away from any sources of ignition or direct sunlight. Proper labeling and segregation from incompatible materials are also essential to ensure safe handling and storage.