3-Hydroxy-5-[(E)-2-(4-methoxyphenyl)vinyl]phenyl beta-D-glucopyranoside

Basic Information

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CAS Number

30197-14-9

Molecular Formula

C21H24O8

Molecular Weight

404.42 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

Fine Chemicals Dyes and Pigments Organic Dyes

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Physical State

Powder

Boiling Point

700.5℃ at 760 mmHg

SMILES

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COC1=CC=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O

InChI

InChI=1S/C21H24O8/c1-27-15-6-4-12(5-7-15)2-3-13-8-14(23)10-16(9-13)28-21-20(26)19(25)18(24)17(11-22)29-21/h2-10,17-26H,11H2,1H3/b3-2+/t17-,18-,19+,20-,21-/m1/s1

InChIKey

MFMQRDLLSRLUJY-DXKBKAGUSA-N

LogP

0.7499000000000002

Topological Polar Surface Area

128.84 Å²

Hydrogen Bond Donor/Acceptor

5 / 8

Complexity

521

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

Storage Conditions

2-8℃

Synonyms & References

English

CHEBI:189522
BS-16472
SPECTRUM1500827
AC-34608
Desoxyrhaponticin
CHEBI:92255
BRD-K52015643-001-01-1
CS-0022757
Spectrum5_000647
Deoxyrhapontin
MFMQRDLLSRLUJY-DXKBKAGUSA-N
BSPBio_003505
NCGC00178025-01
BRD-K14536225-001-02-7
CHEMBL113536
AKOS037514943
(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(E)-2-(4-methoxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
deoxyrha-pontin
Deoxyrhaponticin
s3300
30197-14-9
HY-N2486
MFCD00063444
CCG-38844
trans-Desoxyrhaponticin
Deoxyrhapontigenin O-glucoside
3,5-dihydroxy-4'-methoxystilbene 3-o-β-d-glucoside
(E)-4'-Methoxy-5-(β-D-glucopyranosyloxy)stilbene-3-ol
3-(β-D-Glucopyranosyloxy)-5-[(E)-2-(4-methoxyphenyl)vinyl]phenol
3-Hydroxy-5-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl β-D-glucopyranoside
3,5-DIHYDROXY-4'-METHOXYSTILBENE 3-O-BETA-D-GLUCOSIDE

MDL Number

MFCD00063444

FAQ

What are the physical and chemical properties of 3-Hydroxy-5-[(E)-2-(4-methoxyphenyl)vinyl]phenyl beta-D-glucopyranoside (CAS: 30197-14-9)?

3-Hydroxy-5-[(E)-2-(4-methoxyphenyl)vinyl]phenyl beta-D-glucopyranoside is a white crystalline solid with a molecular weight of approximately 462.46 g/mol. It has a low solubility in water but is more soluble in organic solvents. The compound exhibits specific reactivity towards nucleophiles due to its hydroxyl and phenolic groups. It is stable under neutral and slightly acidic conditions but can degrade under basic conditions.

How is 3-Hydroxy-5-[(E)-2-(4-methoxyphenyl)vinyl]phenyl beta-D-glucopyranoside (CAS: 30197-14-9) typically synthesized?

3-Hydroxy-5-[(E)-2-(4-methoxyphenyl)vinyl]phenyl beta-D-glucopyranoside is typically synthesized via a multistep process involving the coupling of a glucopyranoside to a vinyl derivative. The synthesis often employs palladium-based catalysts and requires careful control of reaction conditions to achieve high yields and selectivity. Common solvents include toluene and dichloromethane, and the reaction is usually carried out at room temperature.

What industries use 3-Hydroxy-5-[(E)-2-(4-methoxyphenyl)vinyl]phenyl beta-D-glucopyranoside (CAS: 30197-14-9)?

3-Hydroxy-5-[(E)-2-(4-methoxyphenyl)vinyl]phenyl beta-D-glucopyranoside is primarily used in the pharmaceutical industry as a potential drug candidate due to its unique chemical structure. It also has applications in the development of novel sensors and semiconductors due to its electronic properties. Additionally, it may find use in polymer research for modifying material properties.

What precautions should be taken when handling 3-Hydroxy-5-[(E)-2-(4-methoxyphenyl)vinyl]phenyl beta-D-glucopyranoside (CAS: 30197-14-9)?

When handling 3-Hydroxy-5-[(E)-2-(4-methoxyphenyl)vinyl]phenyl beta-D-glucopyranoside (CAS: 30197-14-9), it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or fume hood to avoid inhalation of vapors. Spills should be cleaned up immediately using appropriate absorbent materials. Always consult the Safety Data Sheet (SDS) for detailed handling and disposal information.