Registration Dossier
Registration Dossier
Data platform availability banner - registered substances factsheets
Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.
The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.
Diss Factsheets
Use of this information is subject to copyright laws and may require the permission of the owner of the information, as described in the ECHA Legal Notice.
EC number: 203-604-4 | CAS number: 108-67-8
- Life Cycle description
- Uses advised against
- Endpoint summary
- Appearance / physical state / colour
- Melting point / freezing point
- Boiling point
- Density
- Particle size distribution (Granulometry)
- Vapour pressure
- Partition coefficient
- Water solubility
- Solubility in organic solvents / fat solubility
- Surface tension
- Flash point
- Auto flammability
- Flammability
- Explosiveness
- Oxidising properties
- Oxidation reduction potential
- Stability in organic solvents and identity of relevant degradation products
- Storage stability and reactivity towards container material
- Stability: thermal, sunlight, metals
- pH
- Dissociation constant
- Viscosity
- Additional physico-chemical information
- Additional physico-chemical properties of nanomaterials
- Nanomaterial agglomeration / aggregation
- Nanomaterial crystalline phase
- Nanomaterial crystallite and grain size
- Nanomaterial aspect ratio / shape
- Nanomaterial specific surface area
- Nanomaterial Zeta potential
- Nanomaterial surface chemistry
- Nanomaterial dustiness
- Nanomaterial porosity
- Nanomaterial pour density
- Nanomaterial photocatalytic activity
- Nanomaterial radical formation potential
- Nanomaterial catalytic activity
- Endpoint summary
- Stability
- Biodegradation
- Bioaccumulation
- Transport and distribution
- Environmental data
- Additional information on environmental fate and behaviour
- Ecotoxicological Summary
- Aquatic toxicity
- Endpoint summary
- Short-term toxicity to fish
- Long-term toxicity to fish
- Short-term toxicity to aquatic invertebrates
- Long-term toxicity to aquatic invertebrates
- Toxicity to aquatic algae and cyanobacteria
- Toxicity to aquatic plants other than algae
- Toxicity to microorganisms
- Endocrine disrupter testing in aquatic vertebrates – in vivo
- Toxicity to other aquatic organisms
- Sediment toxicity
- Terrestrial toxicity
- Biological effects monitoring
- Biotransformation and kinetics
- Additional ecotoxological information
- Toxicological Summary
- Toxicokinetics, metabolism and distribution
- Acute Toxicity
- Irritation / corrosion
- Sensitisation
- Repeated dose toxicity
- Genetic toxicity
- Carcinogenicity
- Toxicity to reproduction
- Specific investigations
- Exposure related observations in humans
- Toxic effects on livestock and pets
- Additional toxicological data
Basic toxicokinetics
Administrative data
- Endpoint:
- basic toxicokinetics in vivo
- Type of information:
- migrated information: read-across from supporting substance (structural analogue or surrogate)
- Adequacy of study:
- supporting study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: Non-GLP, non-guideline, animal experimental study, published in peer reviewed literature, no restrictions, fully adequate for assessment.
Data source
Reference
- Reference Type:
- publication
- Title:
- Toxicokinetics and metabolism of pseudocumene (1, 2, 4-trimethylbenzene) after inhalation exposure in rats
- Author:
- Swiercz R, Rydzynski K, Wasowicz W, Majcherek W and Wesolowski W.
- Year:
- 2 002
- Bibliographic source:
- Int. J. Occup. Med. Environ. Health, 15, 37-42
Materials and methods
- Objective of study:
- toxicokinetics
- Principles of method if other than guideline:
- Dynamic inhalation chamber study in rats. Time course of 1,2,4-trimethylbenzene in blood and concentrations of dimethylbenzoic acid in urine determined.
- GLP compliance:
- not specified
Test material
- Reference substance name:
- 95-63-3
- IUPAC Name:
- 95-63-3
- Reference substance name:
- 1,2,4-trimethylbenzene
- EC Number:
- 202-436-9
- EC Name:
- 1,2,4-trimethylbenzene
- Cas Number:
- 95-63-6
- Molecular formula:
- C9H12
- IUPAC Name:
- 1,2,4-trimethylbenzene
- Reference substance name:
- pseudocumene
- IUPAC Name:
- pseudocumene
- Details on test material:
- - Name of test material (as cited in study report): pseudocumene
- Analytical purity: ≥97%
- Source: Fluka
- Conversion factors: 1 ppm≈ 4.92 mg/m3, 1 mg/m3 ≈ 0.20 ppm
Constituent 1
Constituent 2
Constituent 3
- Radiolabelling:
- no
Test animals
- Species:
- rat
- Strain:
- other: Wistar Imp:DAK
- Sex:
- male
- Details on test animals or test system and environmental conditions:
- TEST ANIMALS
- Source: no data
- Weight at study initiation: 180-370 g
- no further details
ENVIRONMENTAL CONDITIONS
- Temperature: 20-23°C
- Humidity: 45-60%
- no further details
IN-LIFE DATES:
- no data
Administration / exposure
- Route of administration:
- inhalation: vapour
- Vehicle:
- unchanged (no vehicle)
- Details on exposure:
- TYPE OF INHALATION EXPOSURE: no data
TEST ATMOSPHERE / CHAMBER DESCRIPTION
- Exposure apparatus: dynamic inhalation chambers (volume 250 dm3)
- Vapours of pseudocumene were generated by heating liquid solvents in a washer.
- The desired concentrations of vapours were obtained by diluting them with the air.
- Concentrations of solvent vapours in the exposure chamber were measured every 30 min by means of GC-FID. - Duration and frequency of treatment / exposure:
- Single 6 hr
Doses / concentrations
- Remarks:
- Doses / Concentrations:
25, 100 or 250 ppm (nominal concentration)
- No. of animals per sex per dose / concentration:
- 4
- Control animals:
- no
- Details on dosing and sampling:
- Blood was collected from the tail vein during the 1st, 2nd, 3rd, 4th, 5th and 6th h of exposure, as well as 3, 15, 30, 45 min and 1, 2, 3, 4, 5, 6 h after its termination
Urine samples were collected 18 h after the termination of exposure in metabolic cages. - Statistics:
- The kinetic analysis of pseudocumene in blood was calculated on an open two-compartment model using Sigma Plot 4.0 (Jandel Corporation) for Windows. The Michaelis-Menten parameters (Km and Vmax) for pseudocumene metabolism were estimated by analyzing Lineweaver-Burk plots using Microsoft Excel 5.0.
Results and discussion
Toxicokinetic / pharmacokinetic studies
- Details on absorption:
- The absorption half life of pseudocumene in blood increased with increasing exposure concentration (38, 68 & 101 minutes at 25, 100 & 250ppm respectively)
- Details on excretion:
- The terminal half life for elimination of pseudocumene from blood increased with increasing exposure concentration (3.8, 5.3 & 17.3h at 25, 100 & 250ppm respectively)
Metabolite characterisation studies
- Metabolites identified:
- yes
- Details on metabolites:
- 3,4-dimethylbenzoic acid (3,4-DMBA), 2,4-dimethylbenzoic acid (2,4-DMBA) and 2,5-dimethylbenzoic acid (2,5-DMBA) were measured in urine by GC after hydrolysis. 3,4-DMBA was present at the highest concentration.
Applicant's summary and conclusion
- Conclusions:
- Interpretation of results (migrated information): other:
The rates of uptake and elimination of pseudocumene from blood were dependant on the exposure concentration. All 3 isomers of DMBA were detected in urine, 3,4-DMBA was present at the highest concentration. A significant linear correlation was found between the level of exposure and the concentration of dimethylbenzoic acids. The enzyme kinetic parameters [Km (mg/l) & Vmax (mg/h/kg)] for pseudocumene biotransformation in rats were estimated (3,4-DMBA, Km = 28, Vmax = 96; 2,4-DMBA, Km = 7, Vmax = 25; 2,5-DMBA, Km = 7, Vmax = 23). - Executive summary:
- Both the absorption half life and terminal elimination half life of pseudocumene from blood increased with increasing exposure concentration. The three isomers of dimethylbenzoic acid (3,4 -, 2,4- & 2,5 -) were all detected in urine following hydrolysis; the 3,4 - isomer was present at the highest concentration.
Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
Reproduction or further distribution of this information may be subject to copyright protection. Use of the information without obtaining the permission from the owner(s) of the respective information might violate the rights of the owner.