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1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate

Reference StandardAvailable on request

Buy 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate (CAS 94088-68-3) from Zemixal: C14H14ClNO7, COA and SDS with every lot, worldwide shipping.

Pack sizes
1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate chemical structure
CAS number94088-68-3
FormulaC14H14ClNO7
Molar mass343.71 g/mol
Physical formSolid
HS code38229090
InChIKeyDGWXMMOJNMGHRO-UHFFFAOYSA-N
IUPAC namediethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate

About 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate

1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate belongs to the Vismodegib reference-standard family in the Zemixal catalogue. Identity at a glance (Reference Standard): CAS 94088-68-3, formula C14H14ClNO7 and molar mass 343.71 g/mol. It is handled as a solid.

Use cases we see most often

  • Analytical method development
  • Method validation (AMV)
  • QC release testing
  • ANDA / DMF filings

Standard pack sizes are 10 mg, 25 mg, 50 mg and 100 mg, and custom quantities are quoted on request. You receive a certificate of analysis with characterisation data with each order. Add it to your quote list and our team replies with price, lead time and shipping options within one business day.

Reference standards for Vismodegib

See every impurity, metabolite and related compound we list for this API.

Vismodegib standards

Typical uses

  • Analytical method development
  • Method validation (AMV)
  • QC release testing
  • ANDA / DMF filings

Applications

Specifications and identifiers

Specifications of 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate
Product name1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate
Catalogue numberZX-027603
CAS number94088-68-3
IUPAC namediethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate
Molecular formulaC14H14ClNO7
Molar mass343.71 g/mol
Exact mass343.0459
GradeReference Standard
Physical formSolid
XLogP32.9
H-bond donors / acceptors0 / 7
Topological polar surface area115 Ų
HS code38229090
InChIKeyDGWXMMOJNMGHRO-UHFFFAOYSA-N
SMILESCCOC(=O)C(C(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)OCC
PubChem CID3023496
SynonymsDiethyl (2-chloro-5-nitrobenzoyl)malonate, Diethyl (2-chloro-5-nitrobenzoyl)propanedioate, Propanedioic acid, (2-chloro-5-nitrobenzoyl)-, diethyl ester, Propanedioic acid, 2-(2-chloro-5-nitrobenzoyl)-, 1,3-diethyl ester

Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.

Safety and GHS hazards

No GHS classification is on file for this item. Handle it as an unknown laboratory chemical and request the SDS with your quotation.

Pack sizes

Pack sizes of 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate
10 mgQuoted on request
25 mgQuoted on request
50 mgQuoted on request
100 mgQuoted on request

Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.

Questions about 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate

Which CAS number identifies 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate?
1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate is registered under CAS 94088-68-3. You may also see it listed as Diethyl (2-chloro-5-nitrobenzoyl)malonate, Diethyl (2-chloro-5-nitrobenzoyl)propanedioate, Propanedioic acid, (2-chloro-5-nitrobenzoyl)-, diethyl ester. Our catalogue number for this item is ZX-027603.
What are the formula and molar mass of 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate?
For 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate, its formula is C14H14ClNO7 and its molar mass is 343.71 g/mol. The systematic (IUPAC) name is diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate. InChIKey DGWXMMOJNMGHRO-UHFFFAOYSA-N lets you match it in any structure database.
How is 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate used in pharmaceutical QC?
1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate is a characterised reference material linked to Vismodegib. Laboratories use it to identify and quantify this impurity during method development and validation, stability work, batch release testing and regulatory submissions.
What grade and pack sizes are available for 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate?
This listing is Reference Standard grade. Standard packs are 10 mg, 25 mg, 50 mg, 100 mg. Larger quantities and custom packing can be quoted on request.
Which documents come with 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate?
Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.
Can Zemixal ship 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate to my country?
Yes. 1,3-Diethyl 2-(2-chloro-5-nitrobenzoyl)propanedioate ships worldwide by express courier, air cargo or sea freight, quoted on the Incoterm you prefer, with full export documents.

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