89660
o-Tolunitrile
≥97.0% (GC)
Synonym(s):
2-Methylbenzonitrile
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About This Item
Linear Formula:
CH3C6H4CN
CAS Number:
Molecular Weight:
117.15
Beilstein:
1857417
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
Assay
≥97.0% (GC)
form
liquid
refractive index
n20/D 1.5279 (lit.)
n20/D 1.528
bp
205 °C (lit.)
mp
−13-−11 °C (lit.)
−13-−11 °C
density
0.989 g/mL at 25 °C (lit.)
functional group
nitrile
SMILES string
Cc1ccccc1C#N
InChI
1S/C8H7N/c1-7-4-2-3-5-8(7)6-9/h2-5H,1H3
InChI key
NWPNXBQSRGKSJB-UHFFFAOYSA-N
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Related Categories
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Aquatic Chronic 3 - Skin Irrit. 2
Storage Class Code
10 - Combustible liquids
WGK
WGK 2
Flash Point(F)
179.6 °F - closed cup
Flash Point(C)
82 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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José Arturo Ruiz-Santoyo et al.
The Journal of chemical physics, 144(4), 044303-044303 (2016-02-02)
Rotationally resolved fluorescence excitation spectra of the origin bands in the S1 ← S0 transition of 2-tolunitrile (2TN) and 3-tolunitrile (3TN) have been recorded in the collision-free environment of a molecular beam. Analyses of these data provide the rotational constants
Global Trade Item Number
SKU | GTIN |
---|---|
S663700-1EA | |
89660-250ML | 4061833076422 |
89660-1L |
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