(1S)-1,5-Anhydro-1-[4-chloro-3-(4-hydroxybenzyl)phenyl]-D-glucitol | CAS No. 864070-37-1

(1S)-1,5-Anhydro-1-[4-chloro-3-(4-hydroxybenzyl)phenyl]-D-glucitol

Basic Information

CAS Number

864070-37-1

Molecular Formula

C19H21ClO6

Molecular Weight

380.82 g/mol

AD

Basic Physical Properties

c1cc(ccc1Cc2cc(ccc2Cl)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O

InChI

InChI=1S/C19H21ClO6/c20-14-6-3-11(8-12(14)7-10-1-4-13(22)5-2-10)19-18(25)17(24)16(23)15(9-21)26-19/h1-6,8,15-19,21-25H,7,9H2/t15-,16-,17+,18-,19+/m1/s1

InChIKey

ODQAIMBPQWETBE-FQBWVUSXSA-N

LogP

1.1513000000000004

Topological Polar Surface Area

110.38000000000001 Ų

Hydrogen Bond Donor/Acceptor

5 / 6

Complexity

444

Synonyms & References

English

  • Dapagliflozin Impurity 22
  • Empagliflozin impurity 7
  • Empagliflozin Destetrahydrofuran Impurity
  • 2-[4-chloro-3-[(4-hydroxyphenyl)methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
  • Dapagliflozin Impurity 3
  • (2S,3R,4R,5S,6R)-2-(4-chloro-3-(4-hydroxybenzyl)phenyl)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol

MDL Number

MFCD28387374

FAQ

What is (1S)-1,5-Anhydro-1-[4-chloro-3-(4-hydroxybenzyl)phenyl]-D-glucitol (CAS: 864070-37-1)?

(1S)-1,5-Anhydro-1-[4-chloro-3-(4-hydroxybenzyl)phenyl]-D-glucitol is a chemical compound with the CAS number 864070-37-1. It is a derivative of D-glucitol with specific substituents, characterized by its anhydro structure and unique phenolic substituents. This compound exhibits optical activity due to the presence of a chiral center.

What are the main uses of (1S)-1,5-Anhydro-1-[4-chloro-3-(4-hydroxybenzyl)phenyl]-D-glucitol (CAS: 864070-37-1)?

(1S)-1,5-Anhydro-1-[4-chloro-3-(4-hydroxybenzyl)phenyl]-D-glucitol is primarily used in pharmaceuticals for certain chemical synthesis routes and in research for studying specific molecular interactions. It may also have applications in the fine chemical industry and as a research tool.

Is (1S)-1,5-Anhydro-1-[4-chloro-3-(4-hydroxybenzyl)phenyl]-D-glucitol (CAS: 864070-37-1) safe?

(1S)-1,5-Anhydro-1-[4-chloro-3-(4-hydroxybenzyl)phenyl]-D-glucitol is generally safe when handled with proper precautions. However, it is important to follow safety guidelines, including wearing appropriate personal protective equipment and handling it in a well-ventilated area. Direct contact with skin or ingestion should be avoided.

How should (1S)-1,5-Anhydro-1-[4-chloro-3-(4-hydroxybenzyl)phenyl]-D-glucitol (CAS: 864070-37-1) be stored?

(1S)-1,5-Anhydro-1-[4-chloro-3-(4-hydroxybenzyl)phenyl]-D-glucitol should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent degradation. Avoid exposure to high humidity and maintain a stable temperature to ensure product stability and safety.

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