337110
2-Fluoro-4-methylaniline
99%
Synonym(s):
2-Fluoro-p-toluidine
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About This Item
Linear Formula:
FC6H3(CH3)NH2
CAS Number:
Molecular Weight:
125.14
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
99%
Form:
liquid
assay
99%
form
liquid
refractive index
n20/D 1.533 (lit.)
bp
70-71 °C/7 mmHg (lit.)
density
1.108 g/mL at 25 °C (lit.)
functional group
fluoro
SMILES string
Cc1ccc(N)c(F)c1
InChI
1S/C7H8FN/c1-5-2-3-7(9)6(8)4-5/h2-4H,9H2,1H3
InChI key
ZQEXBVHABAJPHJ-UHFFFAOYSA-N
General description
Rat liver microsomal metabolism of 2-fluoro-4-methylaniline was studied by HPLC.
Application
2-Fluoro-4-methylaniline was used in the preparation of 6-chloro-5-fluoroindole via Leimgruber-Batcho reaction. It was also used in the preparation of an (S)-amino alcohol, 2-amino-3-(2-fluoro-4-methylphenyl)-propan-1-ol.
signalword
Danger
Hazard Classifications
Acute Tox. 3 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
174.2 °F - closed cup
flash_point_c
79 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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Sharon T Marino et al.
Molecules (Basel, Switzerland), 9(6), 405-426 (2007-11-17)
In the past decade there has been a significant growth in the sales of pharmaceutical drugs worldwide, but more importantly there has been a dramatic growth in the sales of single enantiomer drugs. The pharmaceutical industry has a rising demand
S Boeren et al.
Xenobiotica; the fate of foreign compounds in biological systems, 22(12), 1403-1423 (1992-12-01)
1. Rat liver microsomal metabolism of 2-fluoro-, 2-chloro- and 2-bromo-4-methylaniline was investigated using h.p.l.c. Metabolites identified include products from side-chain C-hydroxylation (benzyl alcohols and benzaldehydes) and N-hydroxylation (hydroxylamines and nitroso derivatives). Aromatic ring hydroxylation was not a major reaction pathway.
J M Bentley et al.
Bioorganic & medicinal chemistry letters, 14(9), 2367-2370 (2004-04-15)
A series of 1-(1-indolinyl)-2-propylamines was synthesised and evaluated as 5-HT(2C) receptor agonists for the treatment of obesity. The general methods of synthesis of the precursor indoles are described. The functional efficacy and radioligand binding data for all of the compounds
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 337110-5G | 04061836819606 |
| 337110-1G | 04061836819590 |