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Merck
CN

03040

N-Ethylaniline

puriss., ≥99.0% (GC)

Synonym(s):

Monoethylaniline

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About This Item

Linear Formula:
C6H5NHC2H5
CAS Number:
103-69-5
Molecular Weight:
121.18
EC Number:
203-135-5
UNSPSC Code:
12352100
MDL number:
MFCD00009025
Beilstein/REAXYS Number:
507468

Key Documents

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vapor density

4.2 (vs air)

vapor pressure

0.2 mmHg ( 25 °C)

grade

puriss.

assay

≥99.0% (GC)

expl. lim.

9.5 %

refractive index

n20/D 1.554

bp

205 °C (lit.)

mp

−63 °C (lit.)

density

0.963 g/mL at 25 °C (lit.)

SMILES string

CCNc1ccccc1

InChI

1S/C8H11N/c1-2-9-8-6-4-3-5-7-8/h3-7,9H,2H2,1H3

InChI key

OJGMBLNIHDZDGS-UHFFFAOYSA-N

pictograms

Skull and crossbonesHealth hazard
GHS06,GHS08

signalword

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - STOT RE 2

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 1

flash_point_f

185.0 °F - closed cup

flash_point_c

85 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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Alfonso Pérez-Garrido et al.
Bioorganic & medicinal chemistry, 17(2), 896-904 (2008-12-06)
This paper reports a QSAR study for predicting the complexation of a large and heterogeneous variety of substances (233 organic compounds) with beta-cyclodextrins (beta-CDs). Several different theoretical molecular descriptors, calculated solely from the molecular structure of the compounds under investigation

Global Trade Item Number

SKUGTIN
252964-1KG04061826680230
252964-10G04061825981505
252964-50G04061825981512

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