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511161

Ethyl 2-methyl-3-indoleacetate

98%

Synonym(s):

2-Methyl-1H-indole-3-acetic acid ethyl ester, NSC 289352

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About This Item

Empirical Formula (Hill Notation):
C13H15NO2
CAS Number:
21909-49-9
Molecular Weight:
217.26
NACRES:
NA.22
PubChem Substance ID:
24873425
UNSPSC Code:
12352100
MDL number:
MFCD02093647
Assay:
98%
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assay

98%

refractive index

n20/D 1.571 (lit.)

bp

195-196 °C/3.5 mmHg (lit.)

density

1.11 g/mL at 25 °C (lit.)

SMILES string

CCOC(=O)Cc1c(C)[nH]c2ccccc12

InChI

1S/C13H15NO2/c1-3-16-13(15)8-11-9(2)14-12-7-5-4-6-10(11)12/h4-7,14H,3,8H2,1-2H3

InChI key

SLEXJGHKKHQSDC-UHFFFAOYSA-N

General description

Ethyl 2-methyl-3-indoleacetate, also known as ethyl 2-(2-methyl-1H-indol-3-yl)acetate, is a substituted 1H-indole.

Application

  • Reactant for preparation of hydroxamate derivatives as HDAC inhibitor with anticancer activity
  • Reactant for stereoselective preparation of AG-041R, as a Potent Gastrin/CCK-B Receptor Antagonist

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

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