(1S)-4-Methyl-1-[4-(trifluoromethyl)phenyl]-1-pentanamine | CAS No. 869318-89-8

(1S)-4-Methyl-1-[4-(trifluoromethyl)phenyl]-1-pentanamine

Basic Information

CAS Number

869318-89-8

Molecular Formula

C13H18F3N

Molecular Weight

245.29 g/mol

AD

Basic Physical Properties

CC(C)CC[C@@H](c1ccc(cc1)C(F)(F)F)N

InChI

InChI=1S/C13H18F3N/c1-9(2)3-8-12(17)10-4-6-11(7-5-10)13(14,15)16/h4-7,9,12H,3,8,17H2,1-2H3/t12-/m0/s1

InChIKey

UYCLWAPCXBUSGP-LBPRGKRZSA-N

LogP

4.141400000000003

Topological Polar Surface Area

26.02 Ų

Hydrogen Bond Donor/Acceptor

2 / 1

Synonyms & References

English

  • (1S)-4-Methyl-1-[4-(trifluoromethyl)phenyl]pentylamine
  • (1S)-4-methyl-1-[4-(trifluoromethyl)phenyl]pentan-1-amine
  • (S)-1-(4-(trifluoromethyl)phenyl)-4-methylpentan-1-amine
  • (S)-4-methyl-1-(4-(trifluoromethyl)phenyl)pentan-1-amine

MDL Number

MFCD14560800

FAQ

What are the physical and chemical properties of (1S)-4-Methyl-1-[4-(trifluoromethyl)phenyl]-1-pentanamine (CAS: 869318-89-8)?

(1S)-4-Methyl-1-[4-(trifluoromethyl)phenyl]-1-pentanamine is a white crystalline solid with a molecular weight of approximately 283.15 g/mol. It has a low solubility in water but is more soluble in organic solvents like methanol and dichloromethane. Chemically, it is moderately reactive, particularly with strong acids and bases. It is stable under normal conditions but may degrade under basic conditions.

How is (1S)-4-Methyl-1-[4-(trifluoromethyl)phenyl]-1-pentanamine (CAS: 869318-89-8) typically synthesized?

(1S)-4-Methyl-1-[4-(trifluoromethyl)phenyl]-1-pentanamine is typically synthesized via a multistep process involving the protection of a primary amine, introduction of a trifluoromethyl group, and subsequent deprotection. Commonly used reagents include trifluoromethyl chloroformate and protecting agents like tert-butyldimethylsilyl chloride. The overall yield is moderate, around 50-70%, and the method is selective towards the desired enantiomer with high enantioselectivity.

What industries use (1S)-4-Methyl-1-[4-(trifluoromethyl)phenyl]-1-pentanamine (CAS: 869318-89-8)?

(1S)-4-Methyl-1-[4-(trifluoromethyl)phenyl]-1-pentanamine is primarily used in the pharmaceutical industry for the synthesis of certain drugs. It also finds applications in the semiconductor industry due to its electronic properties and in the development of new materials for sensors and polymers. Its unique chemical structure makes it a valuable intermediate in organic synthesis.

What precautions should be taken when handling (1S)-4-Methyl-1-[4-(trifluoromethyl)phenyl]-1-pentanamine (CAS: 869318-89-8)?

When handling (1S)-4-Methyl-1-[4-(trifluoromethyl)phenyl]-1-pentanamine, it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or under a fume hood to minimize exposure to air. Spills should be immediately cleaned up with appropriate chemicals as per the Material Safety Data Sheet (MSDS) or Safety Data Sheet (SDS). Avoid contact with skin and eyes, and ensure proper disposal according to local regulations.

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