Ethyl 1-cyano-4-oxocyclohexane-1-carboxylate CAS 58774-04-2
| CAS No. | 58774-04-2 |
| Molecular Formula | C10H13NO3 |
| Molecular Weight | 195.22 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including Ethyl 1-cyano-4-oxocyclohexane-1-carboxylate.
Ethyl 1-cyano-4-oxocyclohexane-1-carboxylate (CAS 58774-04-2), molecular formula C10H13NO3 and molecular weight 195.22 g/mol, is a CATO reference standard with documented purity and traceability.
The molecular framework of Ethyl 1-cyano-4-oxocyclohexane-1-carboxylate (C10H13NO3) is characterized by an amino-acid-derived structure, an amide group, a hydroxyl group, an ether linkage. In reversed-phase chromatography, its retention is governed primarily by its high hydrophobicity (logP), which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO manufactures Ethyl 1-cyano-4-oxocyclohexane-1-carboxylate under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C10H13NO3 |
| Molecular Weight | 195.22 g/mol |
| Appearance | Off-white to pale yellow crystalline powder. (faint amine-like odor) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in methanol, ethanol, DMSO |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening |
| Degree of Unsaturation (DBE) | 5.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1973 |
| Nitrogen Atoms | 1 |
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Recommended Standards
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- "2,6-Dimethy-DL-Phenylalanine" (CAS 132466-22-9)
- (S)-2-Amino-2-(2-chloro-4-fluorophenyl)ethanol (CAS 1212863-92-7)
- (1-(tert-Butoxycarbonyl)-4-methyl-1H-indol-2-yl)boronic acid (CAS 352359-21-8)
- (E)-Ethyl 3-(Thiazol-4-Yl)Acrylate (CAS 111601-00-4)
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- tert-Butyl 3-fluoro-3-(((methylsulfonyl)oxy)methyl)azetidine-1-carboxylate (CAS 1466514-75-9)
- 1-[4-(Methylthio)phenyl]-1,4-pentanedione (CAS 189501-33-5)
- C-Peptide（dog） (CAS 39016-05-2)
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