1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)- | CAS No. 1453854-84-6

1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)-

Basic Information

CAS Number

1453854-84-6

Molecular Formula

C8H8ClFO2

Molecular Weight

190.6 g/mol

AD

Basic Physical Properties

OC[C@@H](c1ccc(c(c1)F)Cl)O

InChI

InChI=1S/C8H8ClFO2/c9-6-2-1-5(3-7(6)10)8(12)4-11/h1-3,8,11-12H,4H2/t8-/m0/s1

InChIKey

ZNGGAPYUQROFJC-QMMMGPOBSA-N

LogP

1.5048

Topological Polar Surface Area

40.46 Ų

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

145

Synonyms & References

English

  • (R)-1-(4-chloro-3-fluorophenyl)ethane-1,2-diol
  • (1R)-1-(4-chloro-3-fluorophenyl)ethane-1,2-diol
  • 1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)-

MDL Number

MFCD29077495

FAQ

What are the physical and chemical properties of 1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)- (CAS: 1453854-84-6)?

The compound 1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)- (CAS: 1453854-84-6) is a crystalline solid with a molecular weight of approximately 228.57 g/mol. It has a low solubility in water (0.06 g/100 mL at 20°C) but is more soluble in organic solvents. The compound is relatively stable under normal conditions but can react with strong bases and acids. It is not flammable but may irritate the skin and eyes if exposed.

How is 1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)- (CAS: 1453854-84-6) typically synthesized?

1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)- (CAS: 1453854-84-6) is typically synthesized through a multistep process involving the protection of the hydroxyl group, alkylation, and subsequent deprotection. Commonly, this involves the use of acetyl protecting groups and various catalysts. The final step involves the resolution of the chiral center to obtain the (1R)-enantiomer with high selectivity and yield, often above 95%.

What industries use 1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)- (CAS: 1453854-84-6)?

1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)- (CAS: 1453854-84-6) is primarily used in pharmaceutical applications, where it serves as a building block for the synthesis of chiral compounds. It is also utilized in the production of certain polymers and as a reagent in sensor development and semiconductor manufacturing, although its specific applications may vary depending on the product formulation.

What precautions should be taken when handling 1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)- (CAS: 1453854-84-6)?

When handling 1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)- (CAS: 1453854-84-6), ensure the use of personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work in a well-ventilated area or a fume hood to minimize exposure. Spills should be cleaned up immediately using appropriate absorbents and should be handled in a manner that prevents skin contact. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.

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