222739
2-Phenylbutyronitrile
95%
Synonym(s):
α-Ethylphenylacetonitrile
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About This Item
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Quality Level
Assay
95%
refractive index
n20/D 1.5086 (lit.)
bp
114-115 °C/15 mmHg (lit.)
density
0.974 g/mL at 25 °C (lit.)
functional group
nitrile
phenyl
SMILES string
CCC(C#N)c1ccccc1
InChI
1S/C10H11N/c1-2-9(8-11)10-6-4-3-5-7-10/h3-7,9H,2H2,1H3
InChI key
IZPUPXNVRNBDSW-UHFFFAOYSA-N
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Application
2-Phenylbutyronitrile was used in the preparation of Michael-adducts. It was also used in the preparation of S-amides by nitrile hydratase.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
221.0 °F - closed cup
Flash Point(C)
105 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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t-BuOK-Catalyzed addition of ketones and nitriles to vinylic silanes, phosphines and thio derivatives.
Chemical Communications (Cambridge, England), 8, 745-746 (2001)
Enantioselective nitrile hydratases and amidases from different bacterial isolates.
Journal of Molecular Catalysis. B, Enzymatic, 5(1), 137-141 (1998)
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