Ethyl(1S,5R)-2-oxo-3-oxabicyclo[3.1.0]hexane-1-carboxylate
- CAS
- 145032-58-2
- Formula
- C8H10O4
- MW
- 170.16 g/mol
ZX-036026
API Impurities
2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester
Reference StandardAvailable on request
Buy 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester (CAS 186038-82-4) from Zemixal: C13H21NO4, COA and SDS with every lot, worldwide shipping.
CAS number186038-82-4
FormulaC13H21NO4
Molar mass255.31 g/mol
Physical formSolid
HS code38229090
InChIKeyPZGIWBPMOSUKEV-UHFFFAOYSA-N
IUPAC namediethyl 2-(1-cyano-3-methylbutyl)propanedioate
About 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester
2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester belongs to the Pregabalin reference-standard family in the Zemixal catalogue. For your records (Reference Standard), the material is defined by CAS 186038-82-4, formula C13H21NO4 and molar mass 255.31 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
Safe handling
Hazard communication follows GHS (Warning: H320 and H411). Our SDS lists exposure controls and first-aid measures.
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. Request pricing online and we confirm availability, documentation and freight to your country.
Reference standards for Pregabalin
See every impurity, metabolite and related compound we list for this API.
Pregabalin standardsTypical uses
- Analytical method development
- Method validation (AMV)
- QC release testing
- ANDA / DMF filings
Applications
Specifications and identifiers
| Product name | 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester |
|---|---|
| Catalogue number | ZX-036028 |
| CAS number | 186038-82-4 |
| IUPAC name | diethyl 2-(1-cyano-3-methylbutyl)propanedioate |
| Molecular formula | C13H21NO4 |
| Molar mass | 255.31 g/mol |
| Exact mass | 255.1471 |
| Grade | Reference Standard |
| Physical form | Solid |
| XLogP3 | 2.3 |
| H-bond donors / acceptors | 0 / 5 |
| Topological polar surface area | 76.4 Ų |
| HS code | 38229090 |
| InChIKey | PZGIWBPMOSUKEV-UHFFFAOYSA-N |
| SMILES | CCOC(=O)C(C(CC(C)C)C#N)C(=O)OCC |
| PubChem CID | 11666030 |
| Synonyms | Diethyl 2-(1-cyano-3-methylbutyl)malonate, Diethyl (1-cyano-3-methylbutyl)propanedioate, Diethyl 2-(1-cyano-3-methyl-butyl)propanedioate, 1-cyano-3-methyl butylpropanedioic acid diethyl ester, Diethyl2-(1-cyano-3-methylbutyl)malonate, (r/s)-3-cyano-2-ethoxycarbonyl-5-methyl-hexanoic acid ethyl ester |
Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.
Safety and GHS hazards
Signal word Warning
- H320Causes eye irritation
- H411Toxic to aquatic life with long lasting effects
Precautionary statements P264 + P265, P273, P305 + P351 + P338, P337 + P317, P391, P501
Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.
Pack sizes
| 10 mg | Quoted on request | |
| 25 mg | Quoted on request | |
| 50 mg | Quoted on request | |
| 100 mg | Quoted on request |
Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.
Questions about 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester
Which CAS number identifies 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester?
2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester is registered under CAS 186038-82-4. You may also see it listed as Diethyl 2-(1-cyano-3-methylbutyl)malonate, Diethyl (1-cyano-3-methylbutyl)propanedioate, Diethyl 2-(1-cyano-3-methyl-butyl)propanedioate. Our catalogue number for this item is ZX-036028.
What are the formula and molar mass of 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester?
For 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester, its formula is C13H21NO4 and its molar mass is 255.31 g/mol. The systematic (IUPAC) name is diethyl 2-(1-cyano-3-methylbutyl)propanedioate. InChIKey PZGIWBPMOSUKEV-UHFFFAOYSA-N lets you match it in any structure database.
How is 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester used in pharmaceutical QC?
2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester is a characterised reference material linked to Pregabalin. 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 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester?
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 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester?
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 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester to my country?
Yes. Because 2-Carboxy Ethyl 3 Cyano-5 Methyl Hexanoicacid Ethyl Ester is classed as hazardous, it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.
More Pregabalin standards
More in API Impurities
(3S)-3-(2-Amino-2-oxoethyl)-5-methylhexanoic Acid
- CAS
- 181289-34-9
- Formula
- C9H17NO3
- MW
- 187.24 g/mol
ZX-031978
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