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Basic Description
| Synonyms | EINECS 206-030-2 | Q423957 | NSC 5164 | J-017413 | Suberane | CYCLOHEPTANE | D89252 | AKOS015903170 | UN2241 | Heptamethylene | Cycloheptane, 98% | VTZ53P34JA | InChI=1/C7H14/c1-2-4-6-7-5-3-1/h1-7H | HSDB 59 | NSC5164 | NSC-5164 | cycloheptan | DTXCID1037 |
|---|---|
| Specifications & Purity | ≥98%(GC) |
| Shipped In | Normal |
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Hydrocarbons
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Class
Saturated hydrocarbons
- Subclass Cycloalkanes
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Class
Saturated hydrocarbons
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Superclass
Hydrocarbons
| 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 |
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Mechanisms of Action
| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
|---|
Names and Identifiers
| Pubchem Sid | 488180958 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488180958 |
| IUPAC Name | cycloheptane |
| INCHI | InChI=1S/C7H14/c1-2-4-6-7-5-3-1/h1-7H2 |
| InChIKey | DMEGYFMYUHOHGS-UHFFFAOYSA-N |
| Smiles | C1CCCCCC1 |
| Isomeric SMILES | C1CCCCCC1 |
| WGK Germany | 3 |
| UN Number | 2241 |
| Packing Group | II |
| Molecular Weight | 98.19 |
| Beilstein | 1900279 |
| Reaxy-Rn | 1900279 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1900279&ln= |
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 G2215119 |
Certificate of Analysis | Apr 07, 2025 | C110929 |
| C2218159 |
Certificate of Analysis | Jan 10, 2025 | C110929 |
| C2218515 |
Certificate of Analysis | Jan 10, 2025 | C110929 |
| L2206363 |
Certificate of Analysis | Nov 11, 2022 | C110929 |
| L2206364 |
Certificate of Analysis | Nov 11, 2022 | C110929 |
| C23211025 |
Certificate of Analysis | Jun 21, 2022 | C110929 |
Chemical and Physical Properties
| Refractive Index | 1.445 |
|---|---|
| Flash Point(°F) | 42.8 °F |
| Flash Point(°C) | 6℃ |
| Boil Point(°C) | 118.5°C |
| Melt Point(°C) | -12°C |
| Molecular Weight | 98.190 g/mol |
| XLogP3 | 4.000 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 0 |
| Exact Mass | 98.1096 Da |
| Monoisotopic Mass | 98.1096 Da |
| Topological Polar Surface Area | 0.000 Ų |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Complexity | 19.700 |
| 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 |
Solution Calculators
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