3-Ethylpentanenitrile

Modify Date: 2025-08-26 11:03:29

3-Ethylpentanenitrile Structure
3-Ethylpentanenitrile structure
 Common Name 3-Ethylpentanenitrile
CAS Number 5631-83-4 Molecular Weight 111.18500
Density N/A Boiling Point N/A
Molecular Formula C7H13N Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 3-Ethylpentanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C7H13N
Molecular Weight 111.18500
Exact Mass 111.10500
PSA 23.79000
LogP 2.33628
InChIKey NVDNQCQTQRKQER-UHFFFAOYSA-N
SMILES CCC(CC)CC#N

 Synthetic Route

2-ethylbutyl bromide structure

2-ethylbutyl bromide

CAS#:3814-34-4

~87%

3-Ethylpentanenitrile Structure

3-Ethylpentanen...

CAS#:5631-83-4

Literature: Bristol-Myers Squibb Company Patent: US6509338 B1, 2003 ; US 6509338 B1
Sodium cyanide structure

Sodium cyanide

CAS#:143-33-9

2-ethylbutyl bromide structure

2-ethylbutyl bromide

CAS#:3814-34-4

~89%

3-Ethylpentanenitrile Structure

3-Ethylpentanen...

CAS#:5631-83-4

Literature: Gilligan, Paul J.; Folmer, Beverly K.; Hartz, Richard A.; Koch, Stephanie; Nanda, Kausik K.; Andreuski, Stephen; Fitzgerald, Lawrence; Miller, Keith; Marshall, William J. Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 18 p. 4093 - 4102
sodium cyanide structure

sodium cyanide

CAS#:773837-37-9

2-ethyl-1-chlorobutane structure

2-ethyl-1-chlor...

CAS#:4737-41-1

~%

3-Ethylpentanenitrile Structure

3-Ethylpentanen...

CAS#:5631-83-4

Literature: LEO PHARMA A/S; FELDING, Jakob; LIANG, Xifu; HORNEMAN, Anne Marie; POULSEN, Tina, Dahlerup; LARSEN, Jens, Christian, Hojland Patent: WO2010/22725 A1, 2010 ; Location in patent: Page/Page column 40 ; WO 2010/022725 A1
2-Ethyl-1-butanol structure

2-Ethyl-1-butanol

CAS#:97-95-0

~%

3-Ethylpentanenitrile Structure

3-Ethylpentanen...

CAS#:5631-83-4

Literature: Bruno, Joseph W.; Marks, Tobin J.; Lewis, Frederick D. Journal of the American Chemical Society, 1982 , vol. 104, # 21 p. 5580 - 5585
2-Pentene, (2E)- structure

2-Pentene, (2E)-

CAS#:646-04-8

Acetonitrile structure

Acetonitrile

CAS#:75-05-8

~%

3-Ethylpentanenitrile Structure

3-Ethylpentanen...

CAS#:5631-83-4

3-methylhexanenitrile structure

3-methylhexanen...

CAS#:53783-89-4

Literature: Bruno, Joseph W.; Marks, Tobin J.; Lewis, Frederick D. Journal of the American Chemical Society, 1982 , vol. 104, # 21 p. 5580 - 5585
POTASSIUM CYANIDE structure

POTASSIUM CYANIDE

CAS#:151-50-8

2-ethylbutyl bromide structure

2-ethylbutyl bromide

CAS#:3814-34-4

~61%

3-Ethylpentanenitrile Structure

3-Ethylpentanen...

CAS#:5631-83-4

Literature: Belliotti, Thomas R.; Capiris, Thomas; Ekhato, I. Victor; Kinsora, Jack J.; Field, Mark J.; Heffner, Thomas G.; Meltzer, Leonard T.; Schwarz, Jacob B.; Taylor, Charles P.; Thorpe, Andrew J.; Vartanian, Mark G.; Wise, Lawrence D.; Zhi-Su, Ti; Weber, Mark L.; Wustrow, David J. Journal of Medicinal Chemistry, 2005 , vol. 48, # 7 p. 2294 - 2307
2-ethyl-1-chlorobutane structure

2-ethyl-1-chlor...

CAS#:4737-41-1

Sodium cyanide structure

Sodium cyanide

CAS#:143-33-9

~%

3-Ethylpentanenitrile Structure

3-Ethylpentanen...

CAS#:5631-83-4

Literature: Bruno, Joseph W.; Marks, Tobin J.; Lewis, Frederick D. Journal of the American Chemical Society, 1982 , vol. 104, # 21 p. 5580 - 5585
Cyanoacetic acid structure

Cyanoacetic acid

CAS#:372-09-8

3-Pentanone structure

3-Pentanone

CAS#:96-22-0

~%

3-Ethylpentanenitrile Structure

3-Ethylpentanen...

CAS#:5631-83-4

Literature: Rouillier,P. et al. Bulletin de la Societe Chimique de France, 1966 , p. 689 - 697

 Synonyms

3-ethyl-pentanenitrile
1-cyano-2-ethylbutane
3-ethyl-valeronitrile
3-Aethyl-valeronitril
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