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Benzenepropanenitrile, also known as α-phenyl-α-(phenylmethyl)-, is an organic compound with the chemical formula C16H13N. It is a derivative of benzenepropanenitrile, featuring a phenyl group attached to both the alpha carbon and the phenylmethyl group. Benzenepropanenitrile, a-phenyl-a-(phenylmethyl)- is characterized by its aromatic structure, with a triple bond between the alpha carbon and the phenylmethyl group, and a nitrile group (CN) attached to the alpha carbon. It is a colorless to pale yellow liquid with a strong, pungent odor. Benzenepropanenitrile, α-phenyl-α-(phenylmethyl)-, is used in the synthesis of various pharmaceuticals, agrochemicals, and other organic compounds due to its unique structure and reactivity.

3333-16-2

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3333-16-2 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 3333-16-2 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 3,3,3 and 3 respectively; the second part has 2 digits, 1 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 3333-16:
(6*3)+(5*3)+(4*3)+(3*3)+(2*1)+(1*6)=62
62 % 10 = 2
So 3333-16-2 is a valid CAS Registry Number.

3333-16-2SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-benzyl-2,3-diphenyl-propionitrile

1.2 Other means of identification

Product number -
Other names 2-Benzyl-2,3-diphenyl-propionitril

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:3333-16-2 SDS

3333-16-2Relevant academic research and scientific papers

Lithium naphthalenide-induced reductive alkylation and addition of aryl-and heteroaryl-substituted dialkylacetonitriles

Tsao, Jing-Po,Tsai, Ting-Yueh,Chen, I-Chia,Liu, Hsing-Jang,Zhu, Jia-Liang,Tsao, Sheng-Wei

scheme or table, p. 4242 - 4250 (2011/02/25)

Lithium naphthalenide (LN)-induced reductive alkylation/addition reactions of aryl-, pyridyl-, and 2-thienyl-substituted dialkylacetonitriles have been investigated. Upon treatment with LN in THF at -40°C, both aryl and pyridyl precursors could undergo the reductive decyanation smoothly, and the in situ generated carbanions could be readily trapped by alkyl halides, ketones, aldehydes, or even oxygen to afford a wide range of functionalized aromatic derivatives bearing a newly established quaternary carbon. To effect the desired reductive alkylation of 2-thienyldialkylacetonitriles, a much lower temperature such as -100°C was required. Also with these substrates, an interesting ring-opening/S-alkylation process was observed when the reductive alkylation were performed at -78°C to give 1-alkylsulfanyl-1,3,4-trienes. A mechanistic discussion is given for this observation.

Mono- vs. dialkylation of carbanions. Effects of absolute and relative acidity of the conjugate carbon acids in selectivity control

Ridvan, Ludek,Zavada, Jiri

, p. 14793 - 14806 (2007/10/03)

The title problem was investigated in the reaction of the dibromide 1 with carbanions 2a-2g covering a range greater than 15 pK units in DMSO. It was found that the bis(monoalkylated) product 3 arises exclusively or predominantly from the carbanions 2d-2g derived from the less acidic carbon acids 7d-7g whereas the cyclic product of dialkylation 4 prevails in the reaction of the carbanions 2a-2c derived from the more acidic carbon acids 7a-7c. The alkylation selectivity thus depends critically on the absolute acidity of the carbon acid participating in the reaction. Rationale for this novel, and on basis of earlier studies unexpected finding is provided in terms of eqs. (1)-(4).

Selective mono-benzylation of methylene active compounds with dibenzyl carbonate: benzylation of phenol

Selva, Maurizio,Marques, Carlos Alberto,Tundo, Pietro

, p. 1889 - 1894 (2007/10/02)

Dibenzyl carbonate (DBzlC) has been used to benzylate phenylacetonitrile, benzyl phenylacetate and phenol.In refluxing N,N-dimethylformamide (DMF) as solvent, and in the presence of K2CO3 phenol yielded benzyl phenyl ether and phenylacetonitrile the monobenzylated compound 2,3-diphenylpropionitrile.Likewise, in refluixing N,N-diethylformamide (DEF), benzyl phenyl acetate gave the benzyl 2,3-diphenylpropionate.Selectivity in mono-C-benzyl derivatives was 98-99percent at a conversion up to 90percent.Such unusually high selectivity is explained in terms of a mechanism involving, initially, carboxybenzylation followed by benzylation, rather than direct benzylation

Alkylation and hydrolysis of phenylacetonitriles under microwave irradiation

Barbry,Pasquier,Faven

, p. 3007 - 3013 (2007/10/03)

Alkylation of phenylacetonitriles is performed by solid-liquid phase transfer catalysis in 1-3 minutes under microwave irradiation (one hour with a two-phase system). These nitriles can be quickly hydrolysed in a microwave oven to yield the corresponding amides or acids according to the reaction time.

COPOLYESTERAMIDES CONTAINING POLY(ETHYLENE OXIDE) SOFT SEGMENTS AS NEW AND EFFICIENT PHASE-TRANSFER CATALYSTS

Montanari, Fernando,Penso, Michele,Fortuna, Giorgio della,Re, Alberto

, p. 427 - 432 (2007/10/02)

Copolyesteramides, 1, prepared by melt polycondensation of N,N'-bis(4-methoxycarbonylbenzoyl)hexamethylenediamine, 2, 1,6-hexanediol and poly(ethylene glycol) (PEG 1000), are a new class of polymeric phase-transfer catalysts.Their catalytic activity has been tested in nucleophilic aliphatic substitutions, eliminations, alkylations of activated methylene groups, dichlorocyclopropanation of C=C double bonds, reductions of ketones to alcohols and oxydation of primary alcohols to aldehydes.

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