1,3-Butanedione,1-(3-pyridinyl)-

Modify Date: 2024-01-09 06:21:34

1,3-Butanedione,1-(3-pyridinyl)- Structure
1,3-Butanedione,1-(3-pyridinyl)- structure
Common Name 1,3-Butanedione,1-(3-pyridinyl)-
CAS Number 3594-37-4 Molecular Weight 295.607
Density 1.9±0.1 g/cm3 Boiling Point 446.0±55.0 °C at 760 mmHg
Molecular Formula C7H4BrClN2S2 Melting Point N/A
MSDS N/A Flash Point 223.6±31.5 °C

 Names

Name 1-(Pyridin-3-yl)butane-1,3-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.9±0.1 g/cm3
Boiling Point 446.0±55.0 °C at 760 mmHg
Molecular Formula C7H4BrClN2S2
Molecular Weight 295.607
Flash Point 223.6±31.5 °C
Exact Mass 293.868774
PSA 47.03000
LogP 4.68
Vapour Pressure 0.0±1.0 mmHg at 25°C
Index of Refraction 1.754

 Safety Information

HS Code 2933399090

 Synthetic Route

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1,3-Butanedione,1-(3-pyridinyl)- Structure

1,3-Butanedione...

CAS#:3594-37-4

Literature: NOVARTIS AG; BEATTIE, David; BRUCE, Ian; COLSON, Anny-Odile; CULSHAW, Andrew James; SHARP, Thomas Patent: WO2011/95450 A1, 2011 ; Location in patent: Page/Page column 98 ; WO 2011/095450 A1

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1,3-Butanedione,1-(3-pyridinyl)- Structure

1,3-Butanedione...

CAS#:3594-37-4

Literature: VERTEX PHARMACEUTICALS INCORPORATED; HADIDA-RUAH, Sara, Sabina; ARUMUGAM, Vijayalaksmi; DENINNO, Michael, Paul; FRIEMAN, Bryan, A.; KALLEL, Edward, Adam; MILLER, Mark, Thomas; UY, Johnny; ZHOU, Jinglan Patent: WO2013/109521 A1, 2013 ; Location in patent: Paragraph 00192; 00193 ;

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1,3-Butanedione,1-(3-pyridinyl)- Structure

1,3-Butanedione...

CAS#:3594-37-4

Literature: VERTEX PHARMACEUTICALS INCORPORATED; HADIDA-RUAH, Sara, Sabina; ARUMUGAM, Vijayalaksmi; DENINNO, Michael, Paul; FRIEMAN, Bryan, A.; KALLEL, Edward, Adam; MILLER, Mark, Thomas; UY, Johnny; ZHOU, Jinglan Patent: WO2013/109521 A1, 2013 ; Location in patent: Paragraph 00192; 00195 ;

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1,3-Butanedione,1-(3-pyridinyl)- Structure

1,3-Butanedione...

CAS#:3594-37-4

Literature: Schranck, Johannes; Tlili, Anis; Alsabeh, Pamela G.; Neumann, Helfried; Stradiotto, Mark; Beller, Matthias Chemistry - A European Journal, 2013 , vol. 19, # 38 p. 12624 - 12628

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1,3-Butanedione,1-(3-pyridinyl)- Structure

1,3-Butanedione...

CAS#:3594-37-4

Literature: Korsager, Signe; Nielsen, Dennis U.; Taaning, Rolf H.; Lindhardt, Anders T.; Skrydstrup, Troels Chemistry - A European Journal, 2013 , vol. 19, # 52 p. 17687 - 17691

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1,3-Butanedione,1-(3-pyridinyl)- Structure

1,3-Butanedione...

CAS#:3594-37-4

Literature: Walker, Michael A.; Johnson, Timothy; Ma, Zhuping; Banville, Jacques; Remillard, Roger; Kim, Oak; Zhang, Yunhui; Staab, Andrew; Wong, Henry; Torri, Albert; Samanta, Himadri; Lin, Zeyu; Deminie, Carol; Terry, Brian; Krystal, Mark; Meanwell, Nicholas Bioorganic and Medicinal Chemistry Letters, 2006 , vol. 16, # 11 p. 2920 - 2924

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1,3-Butanedione,1-(3-pyridinyl)- Structure

1,3-Butanedione...

CAS#:3594-37-4

Literature: Ohta, Shunsaku; Tsujimura, Atsuhiko; Okamoto, Masao Chemical & Pharmaceutical Bulletin, 1981 , vol. 29, # 10 p. 2762 - 2768

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1,3-Butanedione,1-(3-pyridinyl)- Structure

1,3-Butanedione...

CAS#:3594-37-4

Literature: Korsager, Signe; Nielsen, Dennis U.; Taaning, Rolf H.; Lindhardt, Anders T.; Skrydstrup, Troels Chemistry - A European Journal, 2013 , vol. 19, # 52 p. 17687 - 17691

 Customs

HS Code 2933399090
Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

1-pyridin-3-ylbutane-1,3-dione
1,3-Butanedione,1-(3-pyridinyl)-
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