Propanedioic acid,2-[(2-nitrophenyl)methylene]-, 1,3-dimethyl ester

Modify Date: 2023-02-08 11:36:37

Propanedioic acid,2-[(2-nitrophenyl)methylene]-, 1,3-dimethyl ester structure	Common Name	Propanedioic acid,2-[(2-nitrophenyl)methylene]-, 1,3-dimethyl ester
	CAS Number	65974-52-9	Molecular Weight	265.21900
	Density	1.335g/cm3	Boiling Point	361.7ºC at 760mmHg
	Molecular Formula	C₁₂H₁₁NO₆	Melting Point	N/A
	MSDS	N/A	Flash Point	151.8ºC

Use of Propanedioic acid,2-[(2-nitrophenyl)methylene]-, 1,3-dimethyl ester

NCI126224 is a TLR4 signaling inhibitor. NCI126224 suppress LPS (HY-D1056)-induced production of NF-κB, TNF-α, IL-1β, and NO in the nanomolar-low micromolar range. NCI126224 can be used for the research of inflammatory diseases[1].

Name	dimethyl 2-[(2-nitrophenyl)methylidene]propanedioate
Synonym	More Synonyms

Description	NCI126224 is a TLR4 signaling inhibitor. NCI126224 suppress LPS (HY-D1056)-induced production of NF-κB, TNF-α, IL-1β, and NO in the nanomolar-low micromolar range. NCI126224 can be used for the research of inflammatory diseases[1].
Related Catalog	Signaling Pathways >> Immunology/Inflammation >> Toll-like Receptor (TLR) Research Areas >> Inflammation/Immunology
References	[1]. Zhang S, et, al. Selection, synthesis, and anti-inflammatory evaluation of the arylidene malonate derivatives as TLR4 signaling inhibitors. Bioorg Med Chem. 2012 Oct 15;20(20):6073-9.

Density	1.335g/cm3
Boiling Point	361.7ºC at 760mmHg
Molecular Formula	C₁₂H₁₁NO₆
Molecular Weight	265.21900
Flash Point	151.8ºC
Exact Mass	265.05900
PSA	98.42000
LogP	1.84740
Index of Refraction	1.578

2-Nitrobenzaldehyde

CAS#:552-89-6

Dimethyl malonate

CAS#:108-59-8

~97%

Propanedioic ac...

CAS#:65974-52-9

Literature: Zhao, Xue Zhi; Smith, Steven J.; Metifiot, Mathieu; Johnson, Barry C.; Marchand, Christophe; Pommier, Yves; Hughes, Stephen H.; Burke Jr., Terrence R. Journal of Medicinal Chemistry, 2014 , vol. 57, # 4 p. 1573 - 1582

Piperidine

CAS#:110-89-4

2-Nitrobenzaldehyde

CAS#:552-89-6

Dimethyl malonate

CAS#:108-59-8

Propanedioic ac...

CAS#:65974-52-9

Literature: Takeda Chemical Industries, Ltd. Patent: US6329389 B1, 2001 ;

Precursor 3
CAS#:552-89-6 2-Nitrobenzaldehyde CAS#:108-59-8 Dimethyl malonate CAS#:110-89-4 Piperidine
DownStream 1
CAS#:103582-31-6 2-[(2-nitrophen...

HMS2882B21

2'-nitrobenzylidenemalonic acid dimethyl ester

dimethyl 2-nitrobenzylidenemalonate

ortho-nitrobenzylidenmalonsaeuredimethylester

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Propanedioic acid,2-[(2-nitrophenyl)methylene]-, 1,3-dimethyl ester

Use of Propanedioic acid,2-[(2-nitrophenyl)methylene]-, 1,3-dimethyl ester

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Biological Activity

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Precursor & DownStream

Synonyms