≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504754368 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504754368 |
| 정식 스마일 | CCOC(=O)C#N |
| IUPAC Name | ethyl cyanoformate |
| InChIKey | MSMGXWFHBSCQFB-UHFFFAOYSA-N |
| INCHI | 1S/C4H5NO2/c1-2-7-4(6)3-5/h2H2,1H3 |
| 이성체 SMILES | CCOC(=O)C#N |
| UN 번호 | 3275 |
| 포장 그룹 | II |
| 분자량 | 99.09 |
| Reaxy-Rn | 635955 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=635955&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic acids and derivatives |
| 분류 | Carboxylic acids and derivatives |
| Subclass | Carboxylic acid derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Carboxylic acid esters |
| Alternative Parents | Nitriles Monocarboxylic acids and derivatives Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Carboxylic acid ester - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound |
| 설명 | This compound belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group). |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | 날짜 | 항목 |
|---|---|---|---|
 L1810178 | Certificate of Analysis | Jul 14, 2026 | E298724 |
| B2219133 | Certificate of Analysis | Dec 10, 2025 | E298724 |
| B2308951 | Certificate of Analysis | Sep 20, 2022 | E298724 |
| B2308963 | Certificate of Analysis | Sep 20, 2022 | E298724 |
| B2308968 | Certificate of Analysis | Sep 20, 2022 | E298724 |
| B2308989 | Certificate of Analysis | Sep 20, 2022 | E298724 |
| 용해성 | Soluble in Chloroform and Methanol |
|---|---|
| 감도 | moisture sensitive |
| 굴절률 | 1.381-1.383 |
| 발화점(°F) | 75.2 °F |
| 발화점(°C) | 24℃ |
| 끓는점(°C) | 115-116℃ |
| 분자량 | 99.090 g/mol |
| XLogP3 | 0.600 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 99.032 Da |
| Monoisotopic Mass | 99.032 Da |
| Topological Polar Surface Area | 50.100 Ų |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Complexity | 110.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Ganchang Lei, Jiayin Wang, Xinhui Liu, Shiping Wang, Lijuan Shen, Shijing Liang, Yingying Zhan, Lilong Jiang. (2025) Atom-Economical Insertion of Hydrogen and Sulfur into Carbon-Nitrogen Triple Bonds Using H2S via Synergistic C-N Sites. EES Catalysis, [PMID:] [10.1039/D5EY00110B] |
