CHemical RISk calculator (CHRIS) - Color additives

Overview

The CHRIS - Color additives module is a tool under development within the Center for Devices and Radiological Health (CDRH) at the Food and Drug Administration (FDA). The tool enables the user to perform rapid, screening level toxicological risk assessments of color additives and additives and impurities associated with the color additive that might be released from a polymer medical device component. CHRIS applies a model that computes an exposure estimate and compares the result to a tolerable exposure (TE) or threshold of toxicological concern (TTC) value. The tool assists the user in determining (a) whether the toxicological risk of a color additive associated substance should be further assessed and/or (b) the potential impact of the substance on device biocompatibility.

Important considerations

  1. CHRIS assists in screening the potential risk of a color additive associated substance in a polymer medical device component. Because color additives and concentrates may contain multiple distinct substances, e.g. impurities and carrier resins, CHRIS can be used to evaluate each substance present in the component individually.

  2. If a color additive associated substance is present in multiple polymer medical device components, CHRIS will not screen the potential risk of the substance from all the polymer components that contain it. CHRIS exposure estimates from each component may be manually summated to estimate total exposure to each substance and manually compared to the TE or TTC for that substance.

  3. If the substance levels present in the device are unknown, the calculator currently cannot be used to screen the risk associated with the respective compound(s).

  4. CHRIS cannot be used to screen the potential risk of polymer medical device components that contact the body by the inhalation route.

  5. The exposure model employed by CHRIS assumes a plane sheet geometry as worst-case. This assumption should be valid for most medical device components; however, potential exceptions exist. Specifically, this assumption can underestimate exposure when the geometry of the exposed surface area is concave, e.g., body contact is limited to the lumen of a catheter. When the exposed surface area is concave, underestimating exposure can be mitigated by assuming the patient will be exposed to all surfaces of the component, i.e., exposed surface area = total component surface area.

Assumptions

In addition to plane sheet geometry, four additional assumptions were made in the derivation of the exposure model, which include:

  1. The polymer does not swell or degrade in-vivo.
  2. The smallest dimension of the colored component is much greater than the size of any color additive particles that may be present (>= 50x).
  3. The color additive is homogeneously distributed throughout the polymer
  4. The total amount of color additive is present in dilute concentrations (<= 2 %) within the colored component

It is important that your colored polymer component complies with the above assumptions so that a conservative exposure estimate is computed.

Usage

The user inputs the following information into CHRIS: (a) the identity, molecular weight (for unlisted compounds), and amount, (b) the identity, mass, and (approximate) density of the polymer matrix, and (c) three (2) medical device characteristics. The required information is described in detail below:

Color additive

Identity - Select the color additive in the component being evaluated via the pull down list. If the color additive is not explicitly listed, please choose either “Other metal oxide color additive” or “Other non-metal oxide color additive” and enter the chemical name, including CAS # if known. If “Other non-metal oxide color additive” is selected, please enter the molecular weight of the color additive in grams per mole. If you are evaluating an additive associated with a color additive please select “Other compound (non-color additive)” and enter the chemical name and molecular weight. Note that the CHRIS is limited to color additive associated substances with molecular weight between 100 and 1100 g/mol. For compounds with molecular weight > 1100 g/mol, this value can be used for a conservative exposure estimate.

Molecular weight - Enter the molecular weight of the substance in grams per mole.

Amount - Enter the total mass of the substance in the component being evaluated expressed in milligrams.

Total impurity concentration - If you have selected a color additive, please enter the combined concentration of all impurities associated with the color additive as a percentage (% mass/mass).

Polymer matrix

Matrix - Please select your polymer matrix from the list. If your polymer is not listed below, please select “Other polymer”. For polymer mixtures/blends, co-polymers, or composites (e.g., glass fiber reinforced matrices), the component or phase that is worst-case for exposure, i.e., the softest or least glassy (lowest Tg) component can be selected if listed (which, in turn, assumes the entire system is composed of the worst-case component or phase). In these scenarios, a justification should be provided for the choice of worst-case component of the polymer system.

Mass - Enter the mass of the polymer matrix in grams.

Density - Enter the estimated density of the polymer matrix in grams per cubic centimeter. Note that a rough estimate (e.g., +/- 10%) is acceptable.

Device characteristics

Exposed surface area - Enter the patient contacting surface area of the color additive containing component being evaluated in square centimeters. This includes both direct and indirect patient contact.

Exposure type - Select the appropriate exposure category: > 30 days = long-term, > 24 hours - 30 days = prolonged, ≤ 24 hours = limited. For limited exposures (≤ 24 hours), please enter the maximum exposure time in hours.

Conformance to Assumptions

The exposure model relies on assumptions that are typically valid for bulk solutes in polymeric device components. However, if any of the assumptions are violated the exposure calculation may not remain protective. Therefore, if the output of CHRIS is used to support a submission to CDRH, users must confirm conformance to the underlying assumptions or provide supporting justification. Examples of considerations when confirming conformance are provided below:

Biostability of the matrix - While many of the matrices listed within CHRIS will not appreciably swell or degrade in any physiological environment, this can not be generalized. For example, silicones may swell in lipid-rich environments. Chemical compatibility of the polymer matrix with the use environment can be assessed based on historical use and/or evaluation of swelling and/or degradation propensity in physiologically relevant media.

Particle/aggregate size and distribution - CHRIS relies on the color additive having a distribution that is macroscopically homogeneous within the matrix (e.g. CAs used for surface marking would be excluded); thus, any particles or aggregates must be small relative to the component and homogeneously distributed. This can be confirmed/justified through the use of particle coatings and/or dispersants in the concentrate to prevent aggregation and promote homogeneity, macroscopic observations of color uniformity, and/or microscopic observations to evaluate the potential for surface segregation phenomena, such as blooming.

Dilute concentration - The model relies on a concentration independent diffusion coefficient, which assumes any color additives are present only in dilute quantities. Confirming that the total amount of color additives present is ≤ 2 m/v % is sufficient to conform with this assumption. It may be possible to justify that the CHRIS calculation for a dilute compound will remain protective if the total concentration is in excess of 2 m/v %, if the presence of additional compound could reasonably be expected to inhibit rather than promote diffusion, e.g. second phase particulates.

Matrix stability - The model parameters/transport properties are established using worst-case values reported in the literature. However, it is unclear if the reported values account for potential degradation (e.g., during sterilization) or other physicochemical changes (e.g., excessive plasticization) that may occur during manufacturing and negatively impact these values. Polymer stability can be confirmed/justified by evidence supporting that manufacturing (including sterilization) does not alter the matrix material of the final device.

Exposure Assessment

Once the fields described have been populated for the polymeric component being evaluated, click the Estimate exposure button. The risk assessment output includes the following information:

  1. Exposure estimation - including the model equations and parameters used in the calculation

  2. Assumptions - a summary of compliance (or lack thereof) to the assumptions underlying the exposure model.

  3. Screening level toxicological risk assessment - A summary of the screening level TRA including calculated margin of safety including any important additional considerations regarding the analysis.

  4. Color additive impurities risk assessment (if applicable) - A summary of a screening level TRA comparing the total amount of impurities to the appropriate TTC value.

Further information

The answers to many frequently asked questions can be found here. If your question is not already addressed or if you have specific issues with CHRIS, please contact Dave Saylor: david.saylor@fda.hhs.gov.