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449059

Sigma-Aldrich

4-(Octyloxy)benzonitrile

98%

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About This Item

Linear Formula:
CH3(CH2)7OC6H4CN
CAS Number:
88374-55-4
Molecular Weight:
231.33
MDL number:
MFCD00043483
UNSPSC Code:
12352100
PubChem Substance ID:
24868449

Assay

98%

refractive index

n20/D 1.513 (lit.)

bp

171-173 °C/2 mmHg (lit.)

density

0.967 g/mL at 25 °C (lit.)

SMILES string

CCCCCCCCOc1ccc(cc1)C#N

InChI

1S/C15H21NO/c1-2-3-4-5-6-7-12-17-15-10-8-14(13-16)9-11-15/h8-11H,2-7,12H2,1H3

InChI key

GFNSBTARZPEIPN-UHFFFAOYSA-N

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H302 + H312 + H332

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

Storage Class Code

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

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
10018MN

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Georg M Fischer et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 15(19), 4857-4864 (2009-03-20)
Pyrrolopyrrole cyanine (PPCy) dyes are presented as a novel class of near-infrared (NIR) chromophores, which are synthesized in a condensation reaction of diketopyrrolopyrrole with heteroarylacetonitrile compounds. Their optical properties are marked by strong and narrow-band NIR absorptions. Complexation products with
Synthesis of liquid crystals materials derived from oxadiazole, isoxazole and tetrazole heterocycles.
dos Santos DR, et al.
ARKIVOC (Gainesville, FL, United States), 17, 157-166 (2008)

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