2,2-Diacetylacetonitrile

Modify Date: 2024-02-29 19:46:44

2,2-Diacetylacetonitrile Structure
2,2-Diacetylacetonitrile structure
Common Name 2,2-Diacetylacetonitrile
CAS Number 3141-59-1 Molecular Weight 125.125
Density 1.1±0.1 g/cm3 Boiling Point 158.2±20.0 °C at 760 mmHg
Molecular Formula C6H7NO2 Melting Point N/A
MSDS N/A Flash Point 49.5±21.8 °C

 Names

Name 2-acetyl-3-oxobutanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 158.2±20.0 °C at 760 mmHg
Molecular Formula C6H7NO2
Molecular Weight 125.125
Flash Point 49.5±21.8 °C
Exact Mass 125.047676
PSA 57.93000
LogP 0.84
Vapour Pressure 2.7±0.3 mmHg at 25°C
Index of Refraction 1.429

 Safety Information

HS Code 2926909090

 Synthetic Route

~75%

2,2-Diacetylacetonitrile Structure

2,2-Diacetylace...

CAS#:3141-59-1

Literature: Zhou, Peiwen; Natale Synthetic Communications, 1998 , vol. 28, # 18 p. 3317 - 3330

~63%

2,2-Diacetylacetonitrile Structure

2,2-Diacetylace...

CAS#:3141-59-1

Literature: Buttke; Niclas Advanced Synthesis and Catalysis, 1996 , vol. 338, # 7 p. 681 - 683

~62%

2,2-Diacetylacetonitrile Structure

2,2-Diacetylace...

CAS#:3141-59-1

Literature: Okimoto, Mitsuhiro; Numata, Kaori; Takahashi, Yukio; Hoshi, Masayuki; Tomozawa, Kenta; Shigemoto, Takamasa Synlett, 2005 , # 16 art. no. U22905ST, p. 2507 - 2509

~0%

2,2-Diacetylacetonitrile Structure

2,2-Diacetylace...

CAS#:3141-59-1

Detail
Literature: Alberola, A.; Gonzalez, A. M.; Guerra, D.; Pulido, F. J. Journal of Heterocyclic Chemistry, 1982 , vol. 19, p. 1073 - 1076

~49%

2,2-Diacetylacetonitrile Structure

2,2-Diacetylace...

CAS#:3141-59-1

Literature: Lock, George A.; Thompson, David W. Journal of the Chemical Society, Dalton Transactions: Inorganic Chemistry (1972-1999), 1980 , # 8 p. 1265 - 1268

~67%

2,2-Diacetylacetonitrile Structure

2,2-Diacetylace...

CAS#:3141-59-1

Literature: Sauers, Ronald R.; Van Arnum, Susan D. Tetrahedron Letters, 1987 , vol. 28, # 47 p. 5797 - 5800

~%

2,2-Diacetylacetonitrile Structure

2,2-Diacetylace...

CAS#:3141-59-1

Literature: Traube Chemische Berichte, 1898 , vol. 31, p. 2943 Justus Liebigs Annalen der Chemie, 1904 , vol. 332, p. 141

~%

2,2-Diacetylacetonitrile Structure

2,2-Diacetylace...

CAS#:3141-59-1

Literature: Musante Gazzetta Chimica Italiana, 1939 , vol. 69, p. 523,533

~0%

2,2-Diacetylacetonitrile Structure

2,2-Diacetylace...

CAS#:3141-59-1

Literature: Sauers, Ronald R.; Van Arnum, Susan D. Tetrahedron Letters, 1987 , vol. 28, # 47 p. 5797 - 5800

 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

2-Acetyl-3-oxobutanenitrile
diacetylacetonitrile
3-cyanopentane-2,4-dione
3-cyano-2,4-pentanedione
3-cyano-acetylacetone
Butanenitrile,2-acetyl-3-oxo
cyanoacetylacetone
Butanenitrile, 2-acetyl-3-oxo-
2-acetyl-3-oxo-butyronitrile
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