≥98%(GC)(mixture of isomers) 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504753539 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504753539 |
| Canonical Smiles | CC1CC(CC(C1)C)C |
| IUPAC Name | 1,3,5-trimethylcyclohexane |
| InChIKey | ODNRTOSCFYDTKF-UHFFFAOYSA-N |
| INCHI | 1S/C9H18/c1-7-4-8(2)6-9(3)5-7/h7-9H,4-6H2,1-3H3 |
| Isomeric SMILES | CC1CC(CC(C1)C)C |
| Molecular Weight | 126.24 |
| Beilstein | 5(4)138 |
| Reaxy-Rn | 1900496 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1900496&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 | Hydrocarbons |
| Class | Saturated hydrocarbons |
| Subclass | Cycloalkanes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Cycloalkanes |
| Alternative Parents | Not available |
| Molecular Framework | Aliphatic homomonocyclic compounds |
| Substituents | Cycloalkane - Aliphatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as cycloalkanes. These are saturated monocyclic hydrocarbons (with or without side chains). |
| 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 |
|---|---|---|---|
 E2613518 | Certificate of Analysis | Mar 10, 2026 | T161701 |
| E2613520 | Certificate of Analysis | Mar 10, 2026 | T161701 |
| F2427412 | Certificate of Analysis | May 27, 2024 | T161701 |
| F2427413 | Certificate of Analysis | May 27, 2024 | T161701 |
| E2306873 | Certificate of Analysis | Mar 31, 2023 | T161701 |
| E2306875 | Certificate of Analysis | Mar 31, 2023 | T161701 |
| E2306881 | Certificate of Analysis | Mar 31, 2023 | T161701 |
| E2306892 | Certificate of Analysis | Mar 31, 2023 | T161701 |
| Refractive Index | 1.4260 to 1.4290 |
|---|---|
| Flash Point(°C) | 19 °C |
| Boil Point(°C) | 140 °C |
| Molecular Weight | 126.240 g/mol |
| XLogP3 | 4.000 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 0 |
| Exact Mass | 126.141 Da |
| Monoisotopic Mass | 126.141 Da |
| Topological Polar Surface Area | 0.000 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 55.000 |
| 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 |
