structure of (2R)-1-methoxypropan-2-amine

(2R)-1-methoxypropan-2-amine

CAS No.: 99636-38-1
M. Wt: 89.136
M. Fa: C4H11NO
InChI Key: NXMXETCTWNXSFG-SCSAIBSYSA-N
Appearance: Colorless Liquid

Names and Identifiers of (2R)-1-methoxypropan-2-amine

CAS Number

99636-38-1

EC Number

620-037-1

IUPAC Name

(2R)-1-methoxypropan-2-amine

InChI

InChI=1S/C4H11NO/c1-4(5)3-6-2/h4H,3,5H2,1-2H3/t4-/m1/s1

InChIKey

NXMXETCTWNXSFG-SCSAIBSYSA-N

Canonical SMILES

CC(COC)N

Isomeric SMILES

C[C@H](COC)N

Physical and chemical properties of (2R)-1-methoxypropan-2-amine

Acidity coefficient

8.84±0.10(Predicted)

Boiling Point

93.7±0.0 °C at 760 mmHg

Density

0.8±0.1 g/cm3

Exact Mass

89.084061

Flash Point

8.9±0.0 °C

Index of Refraction

1.407

LogP

-0.31

Molecular Formula

C4H11NO

Molecular Weight

89.136

PSA

35.25000

Vapour Pressure

48.9±0.1 mmHg at 25°C

Safety Information of (2R)-1-methoxypropan-2-amine

Pictograms

Signal Word

Danger

Safety Data Sheet

Supports customized editing of SDS information and downloading in PDF documents.

Applications of (2R)-1-methoxypropan-2-amine

(2R)-1-methoxypropan-2-amine has diverse applications across several fields:

  • Chemical Industry: It serves as a chiral building block for synthesizing complex molecules.
  • Pharmaceuticals: The compound is a precursor for various pharmaceuticals, particularly in the synthesis of herbicides.
  • Agrochemicals: It is crucial for producing specific enantiomers used in herbicides.
  • Detection Technologies: Polymeric probes incorporating this compound have shown potential for colorimetric detection of nerve agent mimics.

Interaction Studies of (2R)-1-methoxypropan-2-amine

The interaction of (2R)-1-methoxypropan-2-amine with biological systems has been studied primarily concerning its role as a chiral building block in agrochemicals. Its mechanism of action involves binding to specific receptors or enzymes, influencing their activity. For instance, the (S)-enantiomer exhibits predominant activity in certain herbicidal applications, highlighting the importance of stereochemistry in its biological function.

Biological Activity of (2R)-1-methoxypropan-2-amine

The biological activity of (2R)-1-methoxypropan-2-amine is significant due to its chiral nature, which allows it to interact selectively with biological targets such as enzymes and receptors. It may act as an agonist or antagonist at specific receptor sites, modulating biochemical pathways. This compound has been identified as a key building block in the synthesis of herbicides like metolachlor and dimethenamid, which are widely used in agriculture.

Physical sample testing spectrum (NMR) of (2R)-1-methoxypropan-2-amine

Physical sample testing spectrum (NMR) of (2R)-1-methoxypropan-2-amine

Retrosynthesis analysis of (2R)-1-methoxypropan-2-amine

  • Route#1

    Cas:107-98-2
    Cas:99636-38-1
  • Route#2

    Cas:5878-19-3
    Cas:99636-38-1