≥95%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Argon charged,Room temperature Ships 보통 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 14 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504752038 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504752038 |
| 정식 스마일 | CCN=C=S |
| IUPAC Name | isothiocyanatoethane |
| InChIKey | HBNYJWAFDZLWRS-UHFFFAOYSA-N |
| INCHI | 1S/C3H5NS/c1-2-4-3-5/h2H2,1H3 |
| 이성체 SMILES | CCN=C=S |
| WGK 독일 | 3 |
| RTECS | NX8590000 |
| 분자량 | 87.14 |
| Beilstein | 1737705 |
| Reaxy-Rn | 1737705 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1737705&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 | Organosulfur compounds |
| 분류 | Isothiocyanates |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Isothiocyanates |
| Alternative Parents | Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Isothiocyanate - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aliphatic acyclic compound |
| 설명 | This compound belongs to the class of organic compounds known as isothiocyanates. These are organic compounds containing the isothiocyanate group, an isocyanate analogue with the general formula RN=C=S. |
| External Descriptors | isothiocyanate |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | 날짜 | 항목 |
|---|---|---|---|
 K2230737 | Certificate of Analysis | Sep 08, 2026 | E140613 |
| K2230587 | Certificate of Analysis | Sep 08, 2026 | E140613 |
| K2230588 | Certificate of Analysis | Sep 08, 2026 | E140613 |
| K2230640 | Certificate of Analysis | Sep 08, 2026 | E140613 |
| K2105425 | Certificate of Analysis | Aug 06, 2025 | E140613 |
| I2126098 | Certificate of Analysis | Jul 09, 2025 | E140613 |
| C1701093 | Certificate of Analysis | Oct 12, 2024 | E140613 |
| J2010104 | Certificate of Analysis | Aug 20, 2024 | E140613 |
| J2010105 | Certificate of Analysis | Aug 20, 2024 | E140613 |
| I2424325 | Certificate of Analysis | Jun 26, 2024 | E140613 |
| I2424326 | Certificate of Analysis | Jun 26, 2024 | E140613 |
| I2424328 | Certificate of Analysis | Jun 26, 2024 | E140613 |
| I2424321 | Certificate of Analysis | Jun 26, 2024 | E140613 |
| I2424322 | Certificate of Analysis | Jun 26, 2024 | E140613 |
| J2411639 | Certificate of Analysis | Jun 26, 2024 | E140613 |
| L2522103 | Certificate of Analysis | Nov 07, 2022 | E140613 |
| I2511125 | Certificate of Analysis | Nov 07, 2022 | E140613 |
| I1825126 | Certificate of Analysis | Jul 21, 2022 | E140613 |
| 용해성 | Reacts with water. Soluble in chlorinated and aromatic hydrocarbons. Miscible in ethanol and ether. |
|---|---|
| 감도 | Moisture Sensitive |
| 굴절률 | 1.511 |
| 발화점(°F) | 75.2°F |
| 발화점(°C) | 24°C |
| 끓는점(°C) | 132°C |
| 녹는점(°C) | -6℃ |
| 분자량 | 87.150 g/mol |
| XLogP3 | 1.500 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 87.0143 Da |
| Monoisotopic Mass | 87.0143 Da |
| Topological Polar Surface Area | 44.500 Ų |
| Heavy Atom Count | 5 |
| Formal Charge | 0 |
| Complexity | 53.900 |
| 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 |
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