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SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488188986 |
|---|---|
| Canonical Smiles | C(CC(=O)CCCCl)CCl |
| IUPAC Name | 1,7-dichloroheptan-4-one |
| InChIKey | SCKUIKDAPAUGBE-UHFFFAOYSA-N |
| INCHI | 1S/C7H12Cl2O/c8-5-1-3-7(10)4-2-6-9/h1-6H2 |
| Isomeric SMILES | C(CC(=O)CCCCl)CCl |
| Molecular Weight | 183.08 |
| Reaxy-Rn | 1752276 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1752276&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 oxygen compounds |
| Class | Organooxygen compounds |
| Subclass | Carbonyl compounds |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Ketones |
| Alternative Parents | Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Ketone - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be a hydrogen atom). Ketones that have one or more alpha-hydrogen atoms undergo keto-enol tautomerization, the tautomer being an enol. |
| 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 |
|---|---|---|---|
| Certificate of Analysis | Apr 03, 2026 | D193277 | |
| Certificate of Analysis | Jan 21, 2026 | D193277 | |
| Certificate of Analysis | Jan 21, 2026 | D193277 | |
| Certificate of Analysis | Mar 04, 2025 | D193277 | |
| Certificate of Analysis | Mar 04, 2025 | D193277 | |
| Certificate of Analysis | Mar 04, 2025 | D193277 | |
| Certificate of Analysis | Mar 04, 2025 | D193277 | |
| Certificate of Analysis | Jul 17, 2024 | D193277 | |
| Certificate of Analysis | Jul 17, 2024 | D193277 | |
| Certificate of Analysis | May 12, 2021 | D193277 |
| Molecular Weight | 183.070 g/mol |
|---|---|
| XLogP3 | 1.700 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 6 |
| Exact Mass | 182.027 Da |
| Monoisotopic Mass | 182.027 Da |
| Topological Polar Surface Area | 17.100 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 83.600 |
| 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 |