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Key Documents

263427

Sigma-Aldrich

3,5-Bis(trifluoromethyl)phenylacetonitrile

98%

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About This Item

Linear Formula:
(CF3)2C6H3CH2CN
CAS Number:
Molecular Weight:
253.14
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

98%

form

liquid

refractive index

n20/D 1.4234 (lit.)

density

1.42 g/mL at 25 °C (lit.)

SMILES string

FC(F)(F)c1cc(CC#N)cc(c1)C(F)(F)F

InChI

1S/C10H5F6N/c11-9(12,13)7-3-6(1-2-17)4-8(5-7)10(14,15)16/h3-5H,1H2

InChI key

YXGWYBUKRTYHJM-UHFFFAOYSA-N

Application

3,5-Bis(trifluoromethyl)phenylacetonitrile may be used in chemical synthesis.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

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

Certificates of Analysis (COA)

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