Cyclohexadecanone
Also known as Homoexaltone, 8-Cyclohexadecanone
Key facts
What buyers check first
- CAS number
- 2550-52-9
- Formula
- C16H30O
- Molar mass
- 238.42 g/mol
- EC number
- 438-930-8
- HS code
- 291429
- Category
- Aliphatic and alicyclic building blocks
What is Cyclohexadecanone?
Plain description, key identifiers and synonyms
Cyclohexadecanone is a chemical substance with the molecular formula C16H30O and a molar mass of 238.42 g/mol. Its CAS registry number is 2550-52-9.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- cyclohexadecanone
- CAS number
- 2550-52-9 CAS number cross-checked
- EC numbers
- 438-930-8, 607-739-3
- Molecular formula
- C16H30O
- MDL number
- MFCD02262203
- InChIKey
- LXJDKGYSHYYKFJ-UHFFFAOYSA-N
- InChI
- InChI=1S/C16H30O/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-16/h1-15H2
- SMILES (canonical and isomeric)
- C1CCCCCCCC(=O)CCCCCCC1
Synonyms
- Homoexaltone
- 8-Cyclohexadecanone
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 238.42 g/molcalc.Computed value |
|---|---|
| Exact mass | 238.2297 Dacalc.Computed value |
| LogP (octanol/water) | 5.42calc.Computed value |
| Topological polar surface area | 17.07 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 1calc.Computed value |
| Rotatable bonds | 0calc.Computed value |
| Heavy atoms | 17calc.Computed value |
| Rings | 1calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.94calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Lipinski rule of five | Passes (1 violation)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
O=C1CCCCCCCCCCCCCCC1
1 ring, 17 atoms. This chemical is the scaffold itself.
1 other chemical share this scaffoldSafety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H413May cause long lasting harmful effects to aquatic life.
Precautionary statements (2)
- P273Avoid release to the environment.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidCyclohexadecanone suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- Germany, Holzminden ManufacturerUnclaimed profileCyclohexadecanoneGrade, purity and minimum order on requestPrice on request
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Where suppliers are based
1 supplier in 1 country
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Cyclohexadecanone price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Industries and functions
Functional uses
- Fragrance
Regulatory status
Inventories, regulations and trade controls that list this substance
Europe
- EU harmonised classification (CLP Annex VI)Index no: 606-135-00-7
United States
- TSCA inventory (USA)Status: Active in US commerce
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Cyclohexadecanone is traded under.
Cyclanic, cyclenic or cycloterpenic ketones without other oxygen function, other
- United States15.7%
- Japan8.7%
- Germany8.7%
* Partner reported figures, a lower bound.
The HS code shown for Cyclohexadecanone is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Cyclohexadecanone, based on the data on this page
What is Cyclohexadecanone?
What is the CAS number of Cyclohexadecanone?
What is the molecular formula and weight of Cyclohexadecanone?
What is Cyclohexadecanone used for?
Is Cyclohexadecanone hazardous?
What is the HS code of Cyclohexadecanone?
Where can I buy Cyclohexadecanone?
What is the price of Cyclohexadecanone?
Guides for buyers
Practical guides that help when you source, ship or handle Cyclohexadecanone
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
- Guide, Chemical identityCAS registry numbers explainedWhat a CAS number identifies, how the check digit works, why one chemical can have several numbers and what a CAS number cannot tell you about a product.Read
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