structure of 2-Iodo-5-(trifluoromethyl)pyridine

2-Iodo-5-(trifluoromethyl)pyridine

CAS No.: 100366-75-4
M. Wt: 272.994
M. Fa: C6H3F3IN
InChI Key: WSEVWIIOEQZEOU-UHFFFAOYSA-N
Appearance: Off White Solid

Names and Identifiers of 2-Iodo-5-(trifluoromethyl)pyridine

CAS Number

100366-75-4

EC Number

640-461-0

MDL Number

MFCD08741351

IUPAC Name

2-iodo-5-(trifluoromethyl)pyridine

InChI

InChI=1S/C6H3F3IN/c7-6(8,9)4-1-2-5(10)11-3-4/h1-3H

InChIKey

WSEVWIIOEQZEOU-UHFFFAOYSA-N

Canonical SMILES

C1=CC(=NC=C1C(F)(F)F)I

UNSPSC Code

12352100

Physical and chemical properties of 2-Iodo-5-(trifluoromethyl)pyridine

Acidity coefficient

-0.58±0.10(Predicted)

Boiling Point

215.7±40.0 °C at 760 mmHg

Density

2.0±0.1 g/cm3

Exact Mass

272.926208

Flash Point

84.3±27.3 °C

Index of Refraction

1.523

LogP

3.20

Melting Point

82-83 °C(Solv: hexane (110-54-3))

Molecular Formula

C6H3F3IN

Molecular Weight

272.994

PSA

12.89000

Sensitivity

Light Sensitive

Storage condition

Keep in dark place,Sealed in dry,Room Temperature

Vapour Pressure

0.2±0.4 mmHg at 25°C

Safety Information of 2-Iodo-5-(trifluoromethyl)pyridine

Pictograms

Signal Word

Warning

Safety Data Sheet

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

Applications of 2-Iodo-5-(trifluoromethyl)pyridine

2-Iodo-5-(trifluoromethyl)pyridine is utilized in various applications:

  • Pharmaceutical Development: Due to its unique electronic properties, it serves as a building block in the synthesis of pharmaceutical compounds.
  • Material Science: It is used in developing advanced materials due to its chemical stability and reactivity.
  • Agricultural Chemistry: Its derivatives may find applications in agrochemicals, particularly as herbicides or pesticides, owing to their potential biological activity.

Physical sample testing spectrum (NMR) of 2-Iodo-5-(trifluoromethyl)pyridine

Physical sample testing spectrum (NMR) of 2-Iodo-5-(trifluoromethyl)pyridine

Retrosynthesis analysis of 2-Iodo-5-(trifluoromethyl)pyridine

  • Route#1

    Cas:52334-81-3
    Cas:75-36-5
    Cas:100366-75-4
  • Route#2

    Cas:52334-81-3
    Cas:100366-75-4
  • Route#3

    Cas:55304-75-1
    Cas:100366-75-4