4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile

Modify Date: 2025-09-28 07:32:38

4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile Structure
4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile structure
 Common Name 4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile
CAS Number 62584-74-1 Molecular Weight 269.72600
Density N/A Boiling Point N/A
Molecular Formula C16H12ClNO Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile

 Chemical & Physical Properties

Molecular Formula C16H12ClNO
Molecular Weight 269.72600
Exact Mass 269.06100
PSA 40.86000
LogP 4.02718
InChIKey RGFXXOQNQDNBMH-UHFFFAOYSA-N
SMILES N#Cc1ccc(CCC(=O)c2ccc(Cl)cc2)cc1

 Synthetic Route

4-CYANOSTYRENE structure

4-CYANOSTYRENE

CAS#:3435-51-6

4-Chlorobenzaldehyde structure

4-Chlorobenzaldehyde

CAS#:104-88-1

~22%

4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile Structure

4-[3-(4-chlorop...

CAS#:62584-74-1

Literature: Schedler, Michael; Wang, Duo-Sheng; Glorius, Frank Angewandte Chemie - International Edition, 2013 , vol. 52, # 9 p. 2585 - 2589 Angew. Chem., 2013 , vol. 125, # 9 p. 2645 - 2649,6
4-CYANOSTYRENE structure

4-CYANOSTYRENE

CAS#:3435-51-6

4-Chlorobenzaldehyde structure

4-Chlorobenzaldehyde

CAS#:104-88-1

~42%

1,2-bis(4-chlorophenyl)ethanone structure

1,2-bis(4-chlor...

CAS#:51490-05-2

4-(1-(4-chlorophenyl)-1-oxopropan-2-yl)benzonitrile structure

4-(1-(4-chlorop...

CAS#:790639-99-5

Detail
Literature: Schedler, Michael; Wang, Duo-Sheng; Glorius, Frank Angewandte Chemie - International Edition, 2013 , vol. 52, # 9 p. 2585 - 2589 Angew. Chem., 2013 , vol. 125, # 9 p. 2645 - 2649,6
4-CYANOSTYRENE structure

4-CYANOSTYRENE

CAS#:3435-51-6

4-Chlorobenzaldehyde structure

4-Chlorobenzaldehyde

CAS#:104-88-1

~71%

4-(1-(4-chlorophenyl)-1-oxopropan-2-yl)benzonitrile structure

4-(1-(4-chlorop...

CAS#:790639-99-5

4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile Structure

4-[3-(4-chlorop...

CAS#:62584-74-1

Literature: Schedler, Michael; Wang, Duo-Sheng; Glorius, Frank Angewandte Chemie - International Edition, 2013 , vol. 52, # 9 p. 2585 - 2589 Angew. Chem., 2013 , vol. 125, # 9 p. 2645 - 2649,6
4-CYANOSTYRENE structure

4-CYANOSTYRENE

CAS#:3435-51-6

4-Chlorobenzaldehyde structure

4-Chlorobenzaldehyde

CAS#:104-88-1

~2%

4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile Structure

4-[3-(4-chlorop...

CAS#:62584-74-1

Ethanone,1,2-bis(4-chlorophenyl)-2-hydroxy- structure

Ethanone,1,2-bi...

CAS#:4254-20-0

Literature: Schedler, Michael; Wang, Duo-Sheng; Glorius, Frank Angewandte Chemie - International Edition, 2013 , vol. 52, # 9 p. 2585 - 2589 Angew. Chem., 2013 , vol. 125, # 9 p. 2645 - 2649,6
4-CYANOSTYRENE structure

4-CYANOSTYRENE

CAS#:3435-51-6

4-Chlorobenzaldehyde structure

4-Chlorobenzaldehyde

CAS#:104-88-1

~2%

1,2-bis(4-chlorophenyl)ethanone structure

1,2-bis(4-chlor...

CAS#:51490-05-2

4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile Structure

4-[3-(4-chlorop...

CAS#:62584-74-1

Detail
Literature: Schedler, Michael; Wang, Duo-Sheng; Glorius, Frank Angewandte Chemie - International Edition, 2013 , vol. 52, # 9 p. 2585 - 2589 Angew. Chem., 2013 , vol. 125, # 9 p. 2645 - 2649,6
4-[3-(4-chlorophenyl)-3-oxoprop-1-enyl]benzonitrile structure

4-[3-(4-chlorop...

CAS#:62584-60-5

~%

4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile Structure

4-[3-(4-chlorop...

CAS#:62584-74-1

Literature: Wagner; Voigt Pharmazie, 1976 , vol. 31, # 8 p. 528 - 532
1-(4-Chlorophenyl)ethanone structure

1-(4-Chlorophen...

CAS#:99-91-2

~%

4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile Structure

4-[3-(4-chlorop...

CAS#:62584-74-1

Literature: Wagner; Voigt Pharmazie, 1976 , vol. 31, # 8 p. 528 - 532
4-Cyanobenzaldehyde structure

4-Cyanobenzaldehyde

CAS#:105-07-7

~%

4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile Structure

4-[3-(4-chlorop...

CAS#:62584-74-1

Literature: Wagner; Voigt Pharmazie, 1976 , vol. 31, # 8 p. 528 - 532
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Chemsrc provides CAS#:62584-74-1 MSDS, density, melting point, boiling point, structure, etc. Its name is 4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile>> amp version: 4-[3-(4-chlorophenyl)-3-oxopropyl]benzonitrile

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