structure of (S)-8-fluorochroman-4-amine

(S)-8-fluorochroman-4-amine

CAS No.: 1003887-62-4
M. Wt: 167.18000
M. Fa: C9H10FNO
InChI Key: HXACNHXAKSMYNU-QMMMGPOBSA-N

Names and Identifiers of (S)-8-fluorochroman-4-amine

CAS Number

1003887-62-4

MDL Number

MFCD07374035

IUPAC Name

(4S)-8-fluoro-3,4-dihydro-2H-chromen-4-amine

InChI

InChI=1S/C9H10FNO/c10-7-3-1-2-6-8(11)4-5-12-9(6)7/h1-3,8H,4-5,11H2/t8-/m0/s1

InChIKey

HXACNHXAKSMYNU-QMMMGPOBSA-N

Canonical SMILES

C1COC2=C(C1N)C=CC=C2F

Isomeric SMILES

C1COC2=C([C@H]1N)C=CC=C2F

UNSPSC Code

12352100

Physical and chemical properties of (S)-8-fluorochroman-4-amine

Acidity coefficient

8.38±0.20(Predicted)

Boiling Point

228.212ºC at 760 mmHg

Density

1.202 g/cm3

Exact Mass

167.07500

Flash Point

91.82ºC

LogP

2.30830

Molecular Formula

C9H10FNO

Molecular Weight

167.18000

PSA

35.25000

Storage condition

2-8°C

Safety Information of (S)-8-fluorochroman-4-amine

Pictograms

Signal Word

 Warning

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

Applications of (S)-8-fluorochroman-4-amine

(S)-8-fluorochroman-4-amine has potential applications in several areas:

  • Pharmaceutical Development: Due to its possible biological activity, it could serve as a lead compound for developing new drugs targeting neurological or inflammatory conditions.
  • Material Science: Its unique properties may be exploited in creating functional materials or coatings.
  • Chemical Probes: It can be utilized as a chemical probe in biological studies to investigate specific pathways or mechanisms.

Interaction Studies of (S)-8-fluorochroman-4-amine

Interaction studies involving (S)-8-fluorochroman-4-amine are crucial for understanding its biological mechanisms. Research often focuses on:

  • Binding Affinity: Evaluating how well the compound interacts with various biological targets, such as receptors or enzymes.
  • Metabolic Pathways: Investigating how the compound is metabolized within biological systems and identifying potential metabolites.

These studies help elucidate the compound's pharmacokinetics and pharmacodynamics.

Physical sample testing spectrum (NMR) of (S)-8-fluorochroman-4-amine

Physical sample testing spectrum (NMR) of (S)-8-fluorochroman-4-amine

Retrosynthesis analysis of (S)-8-fluorochroman-4-amine

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