Propanedioic acid,2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester

Modify Date: 2024-01-02 11:12:48

Propanedioic acid,2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester Structure
Propanedioic acid,2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester structure
Common Name Propanedioic acid,2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester
CAS Number 6960-47-0 Molecular Weight 352.33900
Density 1.262g/cm3 Boiling Point 507.8ºC at 760 mmHg
Molecular Formula C16H20N2O7 Melting Point N/A
MSDS N/A Flash Point 260.9ºC

 Names

Name diethyl 2-acetamido-2-[(2-nitrophenyl)methyl]propanedioate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.262g/cm3
Boiling Point 507.8ºC at 760 mmHg
Molecular Formula C16H20N2O7
Molecular Weight 352.33900
Flash Point 260.9ºC
Exact Mass 352.12700
PSA 127.52000
LogP 2.05250
Index of Refraction 1.532

 Synthetic Route

~84%

Propanedioic acid,2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester Structure

Propanedioic ac...

CAS#:6960-47-0

Literature: Athena Neurosciences, Inc.; Eli Lilly Company Patent: US6506782 B1, 2003 ;

~%

Propanedioic acid,2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester Structure

Propanedioic ac...

CAS#:6960-47-0

Literature: ELAN PHARMACEUTICALS, INC. Patent: WO2004/98589 A1, 2004 ; Location in patent: Page 164 ; WO 2004/098589 A1

~%

Propanedioic acid,2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester Structure

Propanedioic ac...

CAS#:6960-47-0

Literature: PROSIDION LIMITED Patent: WO2006/59164 A2, 2006 ; Location in patent: Page/Page column 24 ;

~88%

Propanedioic acid,2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester Structure

Propanedioic ac...

CAS#:6960-47-0

Literature: Karl Thomae GmbH Patent: US5616620 A1, 1997 ; US 5616620 A

~83%

Propanedioic acid,2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester Structure

Propanedioic ac...

CAS#:6960-47-0

Literature: Varnavas, Antonio; Lassiani, Lucia; Valenta, Valentina; Mennuni, Laura; Makovec, Francesco; Hadjipavlou-Litina, Dimitra European Journal of Medicinal Chemistry, 2005 , vol. 40, # 6 p. 563 - 581

~%

Propanedioic acid,2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester Structure

Propanedioic ac...

CAS#:6960-47-0

Literature: Bowman,R.E. et al. Journal of the Chemical Society, 1965 , p. 1080 - 1087

~%

Propanedioic acid,2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester Structure

Propanedioic ac...

CAS#:6960-47-0

Literature: Bowman,R.E. et al. Journal of the Chemical Society, 1965 , p. 1080 - 1087

 Synonyms

diethyl N-acetylamino-2-nitrobenzylmalonate
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