3-Oxopentanenitrile

Modify Date: 2025-08-25 10:38:38

3-Oxopentanenitrile structure	Common Name	3-Oxopentanenitrile
	CAS Number	33279-01-5	Molecular Weight	97.11520
	Density	0.956g/cm3	Boiling Point	146.1ºC at 760mmHg
	Molecular Formula	C₅H₇NO	Melting Point	27-30 °C
	MSDS	N/A	Flash Point	42.2ºC

Name	3-oxopentanenitrile
Synonym	More Synonyms

Density	0.956g/cm3
Boiling Point	146.1ºC at 760mmHg
Melting Point	27-30 °C
Molecular Formula	C₅H₇NO
Molecular Weight	97.11520
Flash Point	42.2ºC
Exact Mass	97.05280
PSA	40.86000
LogP	0.87918
Index of Refraction	1.41

Hazard Codes	T: Toxic;
RIDADR	UN3276
Packaging Group	III
Hazard Class	6.1
HS Code	2926909090

n-Ethyl propanoate

CAS#:105-37-3

~79%

3-Oxopentanenitrile

CAS#:33279-01-5

Literature: ASTRAZENECA AB; ASTRAZENECA UK LIMITED Patent: WO2007/99317 A1, 2007 ; Location in patent: Page/Page column 105 ; WO 2007/099317 A1

n-Ethyl propanoate

CAS#:105-37-3

Acetonitrile

CAS#:75-05-8

~10%

3-Oxopentanenitrile

CAS#:33279-01-5

Literature: Ji, Yaohui; Trenkle, William C.; Vowles, James V. Organic Letters, 2006 , vol. 8, # 6 p. 1161 - 1163

Propanoyl chloride

CAS#:79-03-8

Acetonitrile

CAS#:75-05-8

~53%

3-Oxopentanenitrile

CAS#:33279-01-5

Literature: DOMAIN THERAPEUTICS; MAYER, Stanislas; SCHANN, Stephan Patent: WO2013/174822 A1, 2013 ; Location in patent: Page/Page column 94 ;

Propanoyl chloride

CAS#:79-03-8

Ethyl cyanoacetate

CAS#:105-56-6

~0%

3-Oxopentanenitrile

CAS#:33279-01-5

2-Cyano-3-oxo-p...

CAS#:90087-51-7

Literature: Uchikawa, Osamu; Mitsui, Keita; Asakawa, Akiko; Morimoto, Shigeru; Yamamoto, Masataka; Kimura, Hiroyuki; Moriya, Takeo; Mizuno, Masahiro Patent: US2003/187014 A1, 2003 ;

2-Cyano-3-oxo-p...

CAS#:90087-51-7

~85%

3-Oxopentanenitrile

CAS#:33279-01-5

Literature: Yao, Chunxiang; Cuadrado-Peinado, Maria L.; Polasek, Miroslav; Turecek, Frantisek Journal of Mass Spectrometry, 2005 , vol. 40, # 11 p. 1417 - 1428

2-pentenenitrile

CAS#:13284-42-9

~64%

3-Oxopentanenitrile

CAS#:33279-01-5

Literature: Mitsudome, Takato; Yoshida, Syuhei; Mizugaki, Tomoo; Jitsukawa, Koichiro; Kaneda, Kiyotomi Angewandte Chemie - International Edition, 2013 , vol. 52, # 23 p. 5961 - 5964 Angew. Chem., 2013 , vol. 125, # 23 p. 6077 - 6080,4

1-Chloro-2-butanone

CAS#:616-27-3

3-Oxopentanenitrile

CAS#:33279-01-5

Literature: Chem. Zentralbl., , vol. 72, # I p. 95 Chem. Zentralbl., , vol. 71, # I p. 1123

POTASSIUM CYANIDE

CAS#:151-50-8

1-Chloro-2-butanone

CAS#:616-27-3

3-Oxopentanenitrile

CAS#:33279-01-5

Literature: Chem. Zentralbl., , vol. 72, # I p. 95

Precursor 8
CAS#:105-37-3 n-Ethyl propanoate CAS#:75-05-8 Acetonitrile CAS#:79-03-8 Propanoyl chloride CAS#:105-56-6 Ethyl cyanoacetate
CAS#:90087-51-7 2-Cyano-3-oxo-p... CAS#:13284-42-9 2-pentenenitrile CAS#:616-27-3 1-Chloro-2-butanone CAS#:151-50-8 POTASSIUM CYANIDE
DownStream 8
CAS#:4949-44-4 Ethyl 3-oxopent... CAS#:19754-80-4 5-ethylisoxazol... CAS#:64231-10-3 4-ETHYL-7-HYDRO... CAS#:364728-11-0 5-ethyl-2-pyrid...
CAS#:1904-24-1 5-Ethyl-1H-pyra... CAS#:77479-49-3 3-Ethylisoxazol... CAS#:88239-19-4 3-aminopent-2-e... CAS#:95882-16-9 3-aminopent-2-e...

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%

Propionylacetonitrile

Pentanenitrile,3-oxo

3-OXO-PENTANENITRILE

cyanomethyl ethyl ketone

Propanoylacetonitrile

MFCD07367087

1-Cyanobutan-2-one

3-oxopentanonitrile

3-oxapentanenitrile

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3-Oxopentanenitrile

Names

Chemical & Physical Properties

Safety Information

Synthetic Route

Precursor & DownStream

Customs

Synonyms

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.