4-(3-HYDROXY-PROP-1-YNYL)-BENZONITRILE

Modify Date: 2025-09-19 08:55:47

4-(3-HYDROXY-PROP-1-YNYL)-BENZONITRILE Structure
4-(3-HYDROXY-PROP-1-YNYL)-BENZONITRILE structure
Common Name 4-(3-HYDROXY-PROP-1-YNYL)-BENZONITRILE
CAS Number 80151-16-2 Molecular Weight 157.16900
Density 1.2g/cm3 Boiling Point 324.2ºC at 760 mmHg
Molecular Formula C10H7NO Melting Point N/A
MSDS N/A Flash Point 149.8ºC

 Names

Name 4-(3-hydroxyprop-1-ynyl)benzonitrile

 Chemical & Physical Properties

Density 1.2g/cm3
Boiling Point 324.2ºC at 760 mmHg
Molecular Formula C10H7NO
Molecular Weight 157.16900
Flash Point 149.8ºC
Exact Mass 157.05300
PSA 44.02000
LogP 0.90208
Index of Refraction 1.604
InChIKey WUBRVKKUJQPDQN-UHFFFAOYSA-N
SMILES N#Cc1ccc(C#CCO)cc1

 Safety Information

Hazard Codes Xi

 Synthetic Route

~93%

4-(3-HYDROXY-PROP-1-YNYL)-BENZONITRILE Structure

4-(3-HYDROXY-PR...

CAS#:80151-16-2

Literature: Nowak-Krol, Agnieszka; Koszarna, Beata; Yoo, Su Yeon; Chrominski, Jan; Weclawski, Marek K.; Lee, Chang-Hee; Gryko, Daniel T. Journal of Organic Chemistry, 2011 , vol. 76, # 8 p. 2627 - 2634

~97%

4-(3-HYDROXY-PROP-1-YNYL)-BENZONITRILE Structure

4-(3-HYDROXY-PR...

CAS#:80151-16-2

Literature: Togninelli, Andrea; Gevariya, Harsukh; Alongi, Maddalena; Botta, Maurizio Tetrahedron Letters, 2007 , vol. 48, # 28 p. 4801 - 4803

~%

4-(3-HYDROXY-PROP-1-YNYL)-BENZONITRILE Structure

4-(3-HYDROXY-PR...

CAS#:80151-16-2

Literature: Matouosva, Eliska; Ruzicka, Ales; Kunes, Jiri; Kralova, Jarmila; Pour, Milan Chemical Communications, 2011 , vol. 47, # 33 p. 9390 - 9392

~%

4-(3-HYDROXY-PROP-1-YNYL)-BENZONITRILE Structure

4-(3-HYDROXY-PR...

CAS#:80151-16-2

Literature: Maji, Manasi; Mallick, Dibyendu; Mondal, Sayantan; Anoop, Anakuthil; Bag, Subhendu Sekhar; Basak, Amit; Jemmis, Eluvathingal D. Organic Letters, 2011 , vol. 13, # 5 p. 888 - 891

~%

4-(3-HYDROXY-PROP-1-YNYL)-BENZONITRILE Structure

4-(3-HYDROXY-PR...

CAS#:80151-16-2

Literature: Isaac, Methvin; Slassi, Abdelmalik; Silva, Kathleen Da; Arora, Jalaj; MacLean, Neil; Hung, Bill; McCallum, Kirk Bioorganic and Medicinal Chemistry Letters, 2001 , vol. 11, # 11 p. 1371 - 1373
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