(1S,3aR,4S,6aR)-1-(3,4-Dimethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan | CAS No. 41689-51-4

(1S,3aR,4S,6aR)-1-(3,4-Dimethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan

Basic Information

CAS Number

41689-51-4

Molecular Formula

C23H28O7

Molecular Weight

416.47 g/mol

AD

Basic Physical Properties

Physical State

Powder

COC1=CC(=CC(OC)=C1OC)[C@H]1OCC2C1CO[C@@H]2C1=CC(OC)=C(OC)C=C1

InChI

InChI=1S/C23H28O7/c1-24-17-7-6-13(8-18(17)25-2)21-15-11-30-22(16(15)12-29-21)14-9-19(26-3)23(28-5)20(10-14)27-4/h6-10,15-16,21-22H,11-12H2,1-5H3/t15-,16-,21+,22+/m0/s1

InChIKey

MFIHSKBTNZNJIK-RZTYQLBFSA-N

LogP

3.804800000000003

Topological Polar Surface Area

64.61000000000001 Ų

Hydrogen Bond Donor/Acceptor

0 / 7

Complexity

532

Safety Information

View Safety Information

Storage Conditions

2-8℃

Synonyms & References

English

  • 5-methoxyeudesmin
  • magnolin
  • medioresinol dimethyl ether
  • Epimagnolin A
  • (+)-magnolin
  • (1S,3aβ,6aβ)-1β-(3,4-Dimethoxyphenyl)-3a,4,6,6a-tetrahydro-4α-(3,4,5-trimethoxyphenyl)-1H,3H-furo[3,4-c]furan
  • (+)-epi-Magnolin
  • Epimagnolin
  • epi-Magnolin
  • (+)-Epimagnolin,(+)-Epimagnoline A,(+)-epi-Magnolin,epi-Magnolin

MDL Number

MFCD31746993

FAQ

What are the physical and chemical properties of (1S,3aR,4S,6aR)-1-(3,4-Dimethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan (CAS: 41689-51-4)?

The compound (1S,3aR,4S,6aR)-1-(3,4-Dimethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan has a molecular weight of approximately 480.45 g/mol and a crystalline form. It is poorly soluble in water but soluble in common organic solvents like ethanol and dichloromethane. Chemically, it is relatively stable but may react with strong acids or bases. It has a low reactivity under normal conditions but can undergo ring-opening reactions under specific conditions.

How is (1S,3aR,4S,6aR)-1-(3,4-Dimethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan (CAS: 41689-51-4) typically synthesized?

This compound can be synthesized via a multistep process involving the coupling of a 3,4-dimethoxyphenyl group with a 3,4,5-trimethoxyphenyl group. Commonly used methods include palladium-catalyzed cross-coupling reactions, with Pd(PPh3)4 as a catalyst. The synthetic route typically yields a high percentage of the desired product with good regioselectivity and diastereoselectivity. The product is often isolated by recrystallization or column chromatography.

What industries use (1S,3aR,4S,6aR)-1-(3,4-Dimethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan (CAS: 41689-51-4)?

This compound is used in various industries, primarily in the pharmaceutical sector for drug development, as well as in the polymer industry for the production of functional polymers. It is also used in the development of chemical sensors due to its unique spectral properties and in the semiconductor industry for its potential in organic electronics. Its use in these industries leverages its chemical stability and specific functional groups.

What precautions should be taken when handling (1S,3aR,4S,6aR)-1-(3,4-Dimethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan (CAS: 41689-51-4)?

When handling this compound, it is essential to use appropriate personal protective equipment (PPE) such as gloves, goggles, and lab coats. It should be stored in a cool, dry place away from direct sunlight and heat sources. Spills should be cleaned up using appropriate absorbent materials and disposed of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions and emergency procedures. This compound is not highly reactive under normal laboratory conditions, but proper safety protocols are always necessary.

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