MedKoo Cat#: 146048 | Name: Isocetane

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Isocetane is a saturated alkane with a branched structure, primarily used as a solvent or emulsifier in various industrial and cosmetic applications. It is often utilized in personal care products, such as lotions, creams, and sunscreens, due to its ability to improve the texture and spreadability of formulations. Isocetane works by acting as a mild solvent, helping to dissolve and distribute active ingredients evenly across the skin. Additionally, its emollient properties make it effective in enhancing skin hydration and providing a smooth, non-greasy feel.

Chemical Structure

Isocetane
Isocetane
CAS#4390-04-9

Theoretical Analysis

MedKoo Cat#: 146048

Name: Isocetane

CAS#: 4390-04-9

Chemical Formula: C16H34

Exact Mass: 226.2700

Molecular Weight: 226.45

Elemental Analysis: C, 84.87; H, 15.13

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
Isocetane; Cyprane;
IUPAC/Chemical Name
2,2,4,4,6,8,8-heptamethylnonane
InChi Key
VCLJODPNBNEBKW-UHFFFAOYSA-N
InChi Code
1S/C16H34/c1-13(10-14(2,3)4)11-16(8,9)12-15(5,6)7/h13H,10-12H2,1-9H3
SMILES Code
CC(CC(C)(C)C)CC(C)(C)CC(C)(C)C
Appearance
To be determined
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 -4 C for short term (days to weeks) or -20 C for long term(months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 226.45 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Kowert BA. Diffusion of Squalene in Nonaqueous Solvents. ACS Omega. 2022 Aug 23;7(35):31424-31430. doi: 10.1021/acsomega.2c03842. PMID: 36092635; PMCID: PMC9454272. 2: Kowert BA. Diffusion of Polymethylene Chain Molecules in Nonpolar Solvents. J Phys Chem B. 2020 May 7;124(18):3716-3723. doi: 10.1021/acs.jpcb.0c00063. Epub 2020 Apr 23. PMID: 32324410. 3: Kowert BA. Diffusion of Benzene and Alkylbenzenes in Nonpolar Solvents. J Phys Chem B. 2018 Feb 15;122(6):1940-1947. doi: 10.1021/acs.jpcb.7b10078. Epub 2018 Feb 7. PMID: 29411609. 4: Luning Prak DJ, Simms GR, Dickerson T, McDaniel A, Cowart JS. Formulation of 7-Component Surrogate Mixtures for Military Jet Fuel and Testing in Diesel Engine. ACS Omega. 2022 Jan 6;7(2):2275-2285. doi: 10.1021/acsomega.1c05904. PMID: 35071916; PMCID: PMC8772332.