≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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 | 504754498 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504754498 |
| Canonical Smiles | C=C(C#N)Cl |
| IUPAC Name | 2-chloroprop-2-enenitrile |
| InChIKey | OYUNTGBISCIYPW-UHFFFAOYSA-N |
| INCHI | 1S/C3H2ClN/c1-3(4)2-5/h1H2 |
| Isomeric SMILES | C=C(C#N)Cl |
| WGK Germany | 3 |
| UN Number | 1993 |
| Packing Group | I |
| Molecular Weight | 87.51 |
| Beilstein | 773744 |
| Reaxy-Rn | 773744 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=773744&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 | Organohalogen compounds |
| Class | Vinyl halides |
| Subclass | Vinyl chlorides |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Vinyl chlorides |
| Alternative Parents | Nitriles Chloroalkenes Organopnictogen compounds Organochlorides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Chloroalkene - Haloalkene - Vinyl chloride - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as vinyl chlorides. These are vinyl halides in which a chlorine atom is bonded to an sp2-hybridised carbon atom. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 I2201099 | Certificate of Analysis | Mar 18, 2026 | C108040 |
| I2201100 | Certificate of Analysis | Mar 18, 2026 | C108040 |
| I2201101 | Certificate of Analysis | Mar 18, 2026 | C108040 |
| I2201319 | Certificate of Analysis | Mar 18, 2026 | C108040 |
| L2417368 | Certificate of Analysis | Dec 21, 2024 | C108040 |
| D2503369 | Certificate of Analysis | Jul 09, 2024 | C108040 |
| I2118247 | Certificate of Analysis | Jun 15, 2023 | C108040 |
| I2118248 | Certificate of Analysis | Jun 15, 2023 | C108040 |
| I2118249 | Certificate of Analysis | Jun 15, 2023 | C108040 |
| G1820068 | Certificate of Analysis | Apr 14, 2022 | C108040 |
| Refractive Index | 1.429 |
|---|---|
| Flash Point(°F) | 42.8 °F |
| Flash Point(°C) | 6 °C |
| Boil Point(°C) | 88-89°C |
| Melt Point(°C) | -65°C |
| Molecular Weight | 87.510 g/mol |
| XLogP3 | 1.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 86.9876 Da |
| Monoisotopic Mass | 86.9876 Da |
| Topological Polar Surface Area | 23.800 Ų |
| Heavy Atom Count | 5 |
| Formal Charge | 0 |
| Complexity | 86.300 |
| 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. Rong-Kuan Jiang, Yue Pan, Li-Hua Du, Ling-Yan Zheng, Zhi-Kai Sheng, Shi-Yi Zhang, Hang Lin, Ao-Ying Zhang, Han-Jia Xie, Zhi-Kai Yang, Xi-Ping Luo. (2022) Microfluidics Biocatalysis System Applied for the Synthesis of N-Substituted Benzimidazole Derivatives by Aza-Michael Addition. Catalysts, 12 (12): (1658). [PMID:] [10.3390/catal12121658] |
