≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C,Argon charged Ships Wet ice 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 4 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Benzyl isothiocyanate is a naturally-occurring constituent of cruciferous vegetables. It has antibacterial properties and its metabolism in man has been investigated. It inhibits chemically induced cancer in animal models
Benzyl isothiocyanate has been used in the preparation of S-(N-benzylthiocarbamoyl)-L-glutathione and S-(N-benzylthiocarbamoyl)-L-cysteine.
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 | Benzenoids |
| Klasse | Benzene and substituted derivatives |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzene and substituted derivatives |
| Alternative Parents | Isothiocyanates Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Monocyclic benzene moiety - Isothiocyanate - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic homomonocyclic compound |
| Beschreibung | This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene. |
| External Descriptors | a small molecule |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Datum | Artikel |
|---|---|---|---|
 D2410175 | Certificate of Analysis | Mar 09, 2024 | B140288 |
| D2410179 | Certificate of Analysis | Mar 09, 2024 | B140288 |
| C2412115 | Certificate of Analysis | Mar 04, 2024 | B140288 |
| C2412116 | Certificate of Analysis | Mar 04, 2024 | B140288 |
| C2412117 | Certificate of Analysis | Mar 04, 2024 | B140288 |
| C2412118 | Certificate of Analysis | Mar 04, 2024 | B140288 |
| C2412119 | Certificate of Analysis | Mar 04, 2024 | B140288 |
| C2412120 | Certificate of Analysis | Mar 04, 2024 | B140288 |
| E2523074 | Certificate of Analysis | Mar 04, 2024 | B140288 |
| C2328168 | Certificate of Analysis | Jun 06, 2022 | B140288 |
| F2221296 | Certificate of Analysis | Jun 06, 2022 | B140288 |
| F2221459 | Certificate of Analysis | Jun 06, 2022 | B140288 |
| F2221460 | Certificate of Analysis | Jun 06, 2022 | B140288 |
| F2221461 | Certificate of Analysis | Jun 06, 2022 | B140288 |
| G2305168 | Certificate of Analysis | Jun 06, 2022 | B140288 |
| Löslichkeit | Hydrolyzes in water. |
|---|---|
| Empfindlichkeit | Light & Moisture Sensitive. |
| Brechungsindex | 1.6020-1.6050 |
| Flammpunkt (°F) | >230 °F |
| Flammpunkt (°C) | >110 °C |
| Siedepunkt (°C) | 242-243 °C |
| Molekulargewicht | 149.210 g/mol |
| XLogP3 | 3.200 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 149.03 Da |
| Monoisotopic Mass | 149.03 Da |
| Topological Polar Surface Area | 44.500 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 132.000 |
| 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 |
