Benzeneacetonitrile, a-ethyl-a-phenyl-

Modify Date: 2025-08-21 13:25:05

Benzeneacetonitrile, a-ethyl-a-phenyl- Structure
Benzeneacetonitrile, a-ethyl-a-phenyl- structure
Common Name Benzeneacetonitrile, a-ethyl-a-phenyl-
CAS Number 5558-68-9 Molecular Weight 221.29700
Density 1.04g/cm3 Boiling Point 339.5ºC at 760 mmHg
Molecular Formula C16H15N Melting Point N/A
MSDS N/A Flash Point 165.2ºC

 Names

Name 2,2-diphenylbutanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.04g/cm3
Boiling Point 339.5ºC at 760 mmHg
Molecular Formula C16H15N
Molecular Weight 221.29700
Flash Point 165.2ºC
Exact Mass 221.12000
PSA 23.79000
LogP 3.90628
Index of Refraction 1.562
InChIKey NQCFFHSZJWFYEU-UHFFFAOYSA-N
SMILES CCC(C#N)(c1ccccc1)c1ccccc1

 Safety Information

HS Code 2926909090

 Synthetic Route

~86%

Benzeneacetonitrile, a-ethyl-a-phenyl- Structure

Benzeneacetonit...

CAS#:5558-68-9

Literature: Kulp, Stuart S.; Romanelli, Anthony Organic Preparations and Procedures International, 1992 , vol. 24, # 1 p. 7 - 12

~94%

Benzeneacetonitrile, a-ethyl-a-phenyl- Structure

Benzeneacetonit...

CAS#:5558-68-9

Literature: Culkin, Darcy A.; Hartwig, John F. Journal of the American Chemical Society, 2002 , vol. 124, # 32 p. 9330 - 9331

~87%

Benzeneacetonitrile, a-ethyl-a-phenyl- Structure

Benzeneacetonit...

CAS#:5558-68-9

Literature: You, Jingsong; Verkade, John G. Angewandte Chemie - International Edition, 2003 , vol. 42, # 41 p. 5051 - 5053

~59%

Benzeneacetonitrile, a-ethyl-a-phenyl- Structure

Benzeneacetonit...

CAS#:5558-68-9

Literature: Culkin, Darcy A.; Hartwig, John F. Journal of the American Chemical Society, 2002 , vol. 124, # 32 p. 9330 - 9331

~%

Benzeneacetonitrile, a-ethyl-a-phenyl- Structure

Benzeneacetonit...

CAS#:5558-68-9

Literature: You, Jingsong; Verkade, John G. Angewandte Chemie - International Edition, 2003 , vol. 42, # 41 p. 5051 - 5053

~%

Benzeneacetonitrile, a-ethyl-a-phenyl- Structure

Benzeneacetonit...

CAS#:5558-68-9

Literature: You, Jingsong; Verkade, John G. Journal of Organic Chemistry, 2003 , vol. 68, # 21 p. 8003 - 8007

~%

Benzeneacetonitrile, a-ethyl-a-phenyl- Structure

Benzeneacetonit...

CAS#:5558-68-9

Literature: Larsen et al. Journal of the American Chemical Society, 1949 , vol. 71, p. 532

~%

Benzeneacetonitrile, a-ethyl-a-phenyl- Structure

Benzeneacetonit...

CAS#:5558-68-9

Literature: Hoch; Lecocq Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1957 , vol. 245, p. 73

 Customs

HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

Ethyldiphenylacetonitrile
2,2-diphenyl-butyronitrile
2,2-Diphenyl-butyronitril
2,2-Diphenyl-Mutyronitrile
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