4'-CYANO-3,3-DIMETHYLBUTYROPHENONE

Modify Date: 2025-12-02 17:26:21

4'-CYANO-3,3-DIMETHYLBUTYROPHENONE Structure
4'-CYANO-3,3-DIMETHYLBUTYROPHENONE structure
Common Name 4'-CYANO-3,3-DIMETHYLBUTYROPHENONE
CAS Number 898764-23-3 Molecular Weight 201.26400
Density 1.02g/cm3 Boiling Point 332.5ºC at 760 mmHg
Molecular Formula C13H15NO Melting Point N/A
MSDS N/A Flash Point 154.9ºC

 Names

Name 4-(3,3-dimethylbutanoyl)benzonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.02g/cm3
Boiling Point 332.5ºC at 760 mmHg
Molecular Formula C13H15NO
Molecular Weight 201.26400
Flash Point 154.9ºC
Exact Mass 201.11500
PSA 40.86000
LogP 3.17718
Index of Refraction 1.516
InChIKey CVJXFSMSODVEKY-UHFFFAOYSA-N
SMILES CC(C)(C)CC(=O)c1ccc(C#N)cc1

 Safety Information

HS Code 2926909090

 Synthetic Route

~88%

4'-CYANO-3,3-DIMETHYLBUTYROPHENONE Structure

4'-CYANO-3,3-DI...

CAS#:898764-23-3

Literature: Kim, Hye Ryung; Yun, Jaesook Chemical Communications, 2011 , vol. 47, # 10 p. 2943 - 2945

 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

4'-cyano-3,3-dimethylbutyrophenone
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