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459607

4,5-Dioctyloxy-1,2-benzenedicarbonitrile

97%

Synonym(s):

4,5-Dioctyloxyphthalonitrile

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About This Item

Linear Formula:
[CH3(CH2)7O]2C6H2(CN)2
CAS Number:
118132-11-9
Molecular Weight:
384.55
NACRES:
NA.22
PubChem Substance ID:
24869579
UNSPSC Code:
12352100
MDL number:
MFCD00274338
Assay:
97%
Form:
solid
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Quality Segment

assay

97%

form

solid

mp

106-108 °C (lit.)

functional group

nitrile

SMILES string

CCCCCCCCOc1cc(C#N)c(cc1OCCCCCCCC)C#N

InChI

1S/C24H36N2O2/c1-3-5-7-9-11-13-15-27-23-17-21(19-25)22(20-26)18-24(23)28-16-14-12-10-8-6-4-2/h17-18H,3-16H2,1-2H3

InChI key

SSVVHLRGCJLWCP-UHFFFAOYSA-N

Application

4,5-Dioctyloxy-1,2-benzenedicarbonitrile (4,5-Dioctyloxyphthalonitrile) may be used for the preparation of new unsymmetrically substituted DB24C8-phthalocyanines. It may be used for the synthesis of tetrathiafluvalene (TTF)-annulated symmetrical and unsymmetrical phthalocyanines.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Codes

H302 + H312 + H332

Hazard Classifications

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

Storage Class

11 - Combustible Solids

WGK

WGK 3

Flash Point (°F)

Not applicable

Flash Point (°C)

Not applicable

PPE (personal protective equipment)

dust mask type N95 (US), Eyeshields, Gloves

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