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Merck
CN

D89905

N,N-Diethylaniline

98%

Synonym(s):

DEA

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About This Item

Linear Formula:
(C2H5)2NC6H5
CAS Number:
91-66-7
Molecular Weight:
149.23
EC Number:
202-088-8
MDL number:
MFCD00009042
Beilstein/REAXYS Number:
742483

Key Documents

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InChI

1S/C10H15N/c1-3-11(4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3

InChI key

GGSUCNLOZRCGPQ-UHFFFAOYSA-N

SMILES string

CCN(CC)c1ccccc1

vapor density

5.2 (vs air)

vapor pressure

1 mmHg ( 49.7 °C)

assay

98%

autoignition temp.

1166 °F

refractive index

n20/D 1.542 (lit.)

bp

217 °C (lit.)

mp

−38 °C (lit.)

density

0.938 g/mL at 25 °C (lit.)

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Legal Information

DuPont product

signalword

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Aquatic Chronic 2 - Skin Irrit. 2 - STOT RE 2 Oral

Storage Class

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

wgk

WGK 2

flash_point_f

190.4 °F - closed cup

flash_point_c

88 °C - closed cup

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
11714TG
07620EG
06126AV
04912LX
03728DG

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Giorgio Ottaviani et al.
Journal of medicinal chemistry, 50(4), 742-748 (2007-02-16)
The development of in silico and in vitro tools to estimate or predict the passive human skin permeation and distribution of new chemical entities, useful in dermal drug delivery, in absorption studies of toxic compounds, and in the cosmetics industry

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