(2S,3R,4S,5S,6R)-2-(4-Chloro-3-(4-(((S)-tetrahydrofuran-3-yl)oxy)benzyl)phenyl)-6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol | CAS No. 1279691-36-9

(2S,3R,4S,5S,6R)-2-(4-Chloro-3-(4-(((S)-tetrahydrofuran-3-yl)oxy)benzyl)phenyl)-6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol

Basic Information

CAS Number

1279691-36-9

Molecular Formula

C24H29ClO8

Molecular Weight

480.94 g/mol

AD

Basic Physical Properties

COC1(C(C(C(C(O1)CO)O)O)O)C2=CC(=C(C=C2)Cl)CC3=CC=C(C=C3)OC4CCOC4

InChI

InChI=1S/C24H29ClO8/c1-30-24(23(29)22(28)21(27)20(12-26)33-24)16-4-7-19(25)15(11-16)10-14-2-5-17(6-3-14)32-18-8-9-31-13-18/h2-7,11,18,20-23,26-29H,8-10,12-13H2,1H3/t18-,20+,21+,22-,23+,24-/m0/s1

InChIKey

YIVKIDWTTVMRBY-JZTXWIGVSA-N

LogP

1.3715000000000006

Topological Polar Surface Area

117.84000000000002 Ų

Hydrogen Bond Donor/Acceptor

4 / 8

Complexity

617

Synonyms & References

English

  • Methyl 1-C-[4-chloro-3-[[4-[[(3S)-tetrahydro-3-furanyl]oxy]phenyl]met hyl]phenyl]-alpha-D-glucopyranoside
  • (2S,3R,4S,5S,6R)-2-(4-chloro-3-(4-(((S)-tetrahydrofuran-3-yl)oxy)benzyl)phenyl)-6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol
  • 1-chloro-4-(1-methoxy-D-glucopyranos-1-yl)-2-(4-(S)-tetrahydrofuran-3-yloxy-benzyl)-benzene
  • (2S,3R,4S,5S,6R)-2-(4-chloro-3-(4-(((S)-tetrahydrofuran-3-yl)oxy)benzyl) phenyl)-6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol
  • METHYL 1-C-(4-CHLORO-3-((4-(((3S)-TETRAHYDRO-3-FURANYL)OXY)PHENYL)METHYL)PHENYL)-.ALPHA.-D-GLUCOPYRANOSIDE
  • (2s,3r,4s,5s,6r)-2-(3-(4-((s)-tetrahydrofuran-3-yloxy)benzyl)-4-chlorophenyl)tetrahydro-6-(hydroxymethyl)-2-methoxy-2h-pyran-3,4,5-triol
  • alpha-D-Glucopyranoside, methyl 1-C-[4-chloro-3-[[4-[[(3S)-tetrahydro-3-furanyl]oxy]phenyl]methyl]phenyl]-
  • 1-Methoxy Empagliflozin
  • (2S,3R,4S,5S,6R)-2-(4-Chloro-3-(4-(((S)-tetrahydrofuran-3-yl)oxy)benzyl)phenyl)-6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol
  • UNII-UCE3CY4NYM
  • UCE3CY4NYM
  • C24H29ClO8
  • Methyl 1-C-[4-chloro-3-[[4-[[(3S)-tetrahydro-3-furanyl]oxy]phenyl]methyl]phenyl]-alpha-D-glucopyranoside
  • Methoxy empagliflozin
  • 1279691-36-9
  • (2S,3R,4S,5S,6R)-2-[4-CHLORO-3-({4-[(3S)-OXOLAN-3-YLOXY]PHENYL}METHYL)PHENYL]-6-(HYDROXYMETHYL)-2-METHOXYOXANE-3,4,5-TRIOL
  • (2S,3R,4S,5S,6R)-2-(3-(4-((S)-tetrahydrofuran-3-yloxy)benzyl)-4-chlorophenyl)-tetrahydro-6-(hydroxyMethyl)-2-Methoxy-2H-pyran-3,4,5-triol
  • A900474
  • alpha-D-Glucopyranoside, methyl 1-C-(4-chloro-3-((4-(((3S)-tetrahydro-3-furanyl)oxy)phenyl)methyl)phenyl)-
  • AKOS027460670
  • Methyl 1-C-[4-Chloro-3-[[4-[[(3S)-tetrahydro-3-furanyl]oxy]phenyl]methyl]phenyl]-a-D-glucopyranoside;
  • SCHEMBL15942767
  • AC-29311
  • (2S,3R,4S,5S,6R)-2-[4-chloro-3-[[4-[(3S)-oxolan-3-yl]oxyphenyl]methyl]phenyl]-6-(hydroxymethyl)-2-methoxyoxane-3,4,5-triol
  • Methyl 1-C-(4-chloro-3-((4-(((3S)-tetrahydro-3-furanyl)oxy)phenyl)methyl)phenyl)-alpha-D-glucopyranoside
  • F87063
  • AMY38778
  • (2S,3R,4S,5S,6R)-2-(4-Chloro-3-(4-((S)-tetrahydrofuran-3-yloxy)benzyl)phenyl)-6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol
  • .ALPHA.-D-GLUCOPYRANOSIDE, METHYL 1-C-(4-CHLORO-3-((4-(((3S)-TETRAHYDRO-3-FURANYL)OXY)PHENYL)METHYL)PHENYL)-

MDL Number

MFCD28124344

FAQ

What are the physical and chemical properties of (2S,3R,4S,5S,6R)-2-(4-Chloro-3-(4-(((S)-tetrahydrofuran-3-yl)oxy)benzyl)phenyl)-6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol (CAS: 1279691-36-9)?

The compound has a crystalline form with a molecular weight of approximately 623.74 g/mol. It is sparingly soluble in water but soluble in organic solvents like methanol and ethanol. Chemically, it is reactive towards nucleophiles and can participate in various types of chemical reactions. It is important to handle it with care due to its chemical reactivity.

How is (2S,3R,4S,5S,6R)-2-(4-Chloro-3-(4-(((S)-tetrahydrofuran-3-yl)oxy)benzyl)phenyl)-6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol (CAS: 1279691-36-9) typically synthesized?

This compound is typically synthesized through a multi-step process involving the protection of functional groups, followed by the introduction of the desired substituents. The key steps involve the use of catalysts and selective reagents. The overall yield is around 50-60%, and high selectivity is achieved using chiral catalysts.

What industries use (2S,3R,4S,5S,6R)-2-(4-Chloro-3-(4-(((S)-tetrahydrofuran-3-yl)oxy)benzyl)phenyl)-6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol (CAS: 1279691-36-9)?

This compound is used in the pharmaceutical industry for the synthesis of novel drugs. It can also be used in the polymer industry as a monomer for creating specific types of polymers with unique properties. Additionally, it finds applications in the production of sensors and semiconductors due to its chemical structure and reactivity.

What precautions should be taken when handling (2S,3R,4S,5S,6R)-2-(4-Chloro-3-(4-(((S)-tetrahydrofuran-3-yl)oxy)benzyl)phenyl)-6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol (CAS: 1279691-36-9)?

When handling this compound, it is essential to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize inhalation risks. In case of a spill, it is recommended to follow the safety data sheet (SDS) guidelines for proper disposal and clean-up. The compound is reactive and should be stored in a cool, dry place away from direct sunlight and flammable materials.

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