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MedKoo Cat#: 123563 | Name: NCI126224

Description:

WARNING: This product is for research use only, not for human or veterinary use.

NCI126224 is a TLR inhibitor.

Chemical Structure

NCI126224
NCI126224
CAS#65974-52-9

Theoretical Analysis

MedKoo Cat#: 123563

Name: NCI126224

CAS#: 65974-52-9

Chemical Formula: C12H11NO6

Exact Mass: 265.0600

Molecular Weight: 265.22

Elemental Analysis: C, 54.34; H, 4.18; N, 5.28; O, 36.19

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
nci126224; dimethyl 2-[(2-nitrophenyl)methylidene]propanedioate; MLS000737573; NCI-126224
IUPAC/Chemical Name
dimethyl 2-(2-nitrobenzylidene)malonate
InChi Key
LKLMASCOTOBEMT-UHFFFAOYSA-N
InChi Code
InChI=1S/C12H11NO6/c1-18-11(14)9(12(15)19-2)7-8-5-3-4-6-10(8)13(16)17/h3-7H,1-2H3
SMILES Code
COC(=O)C(=CC1=CC=CC=C1[N+](=O)[O-])C(=O)OC
Appearance
To be determined
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 265.22 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
Zhang S, Cheng K, Wang X, Yin H. 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. doi: 10.1016/j.bmc.2012.08.022. Epub 2012 Aug 25. PMID: 22985959; PMCID: PMC3517184.