Data report
Logged in as: Mike Dewhirst, ABC Australia Pty Ltd
Always refresh your browser to see any changes: 2022-04-15 06:15:19 UTC
This report shows data used as input for categorisation plus generated information of possible interest to AICIS in the event of an audit.
Industrial chemical data |
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Trade or chemical name: | 2,3-dihydroxy-[2-(2-hydroxy)ethyl]-[3-(2-hydroxy)propyl]-[(9Z,12Z)-octadeca-9,12-dienyl]azanium; chloride |
CAS name: | 2,3-dihydroxypropyl-[2-(2-hydroxyethoxy)ethyl]-[3-(2-hydroxyethoxy)propyl]-[(9Z,12Z)-octadeca-9,12-dienyl]azanium; chloride |
Portfolio ID: | NIC1005242 |
Division | ABC Australia Pty Ltd - Operations |
Access status | Default - all identifying information (name, CAS etc) visible |
Physical state | Liquid |
Origin | Imported |
Information availability | Introducer does know the CAS number and CAS name for the introduced chemical |
CAS number | 168677-75-6 |
AICIS listing | Searched for but not found |
CAS name | 2,3-dihydroxypropyl-[2-(2-hydroxyethoxy)ethyl]-[3-(2-hydroxyethoxy)propyl]-[(9Z,12Z)-octadeca-9,12-dienyl]azanium; chloride |
IUPAC name | Not entered |
INCI name | Not entered |
Nano-material | No |
Nano-soluble | No |
Incidental nano-material | No |
UVCB substance | Not applicable |
UVCB substance description | Not applicable |
GM product | No |
Name of GM organism | Not applicable |
Biological chemical | Yes |
Biochemical | No |
Biocidal active | No |
Organotin | No |
UV filter | No |
Polyhalogenated organic | No |
Fully fluorinated carbons | No |
Highly branched organic | Not applicable |
Persistent | No |
Readily biodegradable | No |
Bioconcentration factor | Not entered |
Bioaccumulation factor | Not entered |
Octanol/Water partition ratio | Not entered |
Aqueous solubility | 420 |
Environment info required for AICIS: 12 Bioaccumulation potential: Aqueous solubility | 08 November 2021
Information that demonstrates that the chemical has a solubility in water that is >5 g/L, measured following an acceptable test guideline for water solubility
OECD Test 105: Water Solubility |
CIH company | Not entered |
Information holder | Adrian Thomas
adrian@chemicalia.com ABC Australia Pty Ltd 1234567 Elsewhere Qld 4444 Australia |
International assessment | Not entered |
International health assessment | No |
Permission to use entire health assessment report | Not applicable |
International environment assessment | No |
Permission to use entire environment assessment report | Not applicable |
Rotterdam-Stockholm-Minamata | Not detected |
Formula | C₃₀H₆₀ClNO₆ |
2D structure | Not found |
Chemical structure | |
Molecular weight | 566.3 g/mol |
EC No | Not entered |
ChemSpider ID | 64881210 |
Standard InChIKey | IBBTWBUZVVGGOQ-NBTZWHCOSA-M (ChemSpider) |
Standard InChI | InChI=1S/C30H60NO6.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-31(28-30(35)29-34,21-25-37-27-23-33)20-18-24-36-26-22-32;/h6-7,9-10,30,32-35H,2-5,8,11-29H2,1H3;1H/q+1;/p-1/b7-6-,10-9-; (ChemSpider) |
SMILES structure | CCCCC/C=C\C/C=C\CCCCCCCC[N+](CCCOCCO)(CCOCCO)CC(CO)O.[Cl-] (ChemSpider)
CCCCC/C=C\\C/C=C\\CCCCCCCC[N+](CCCOCCO)(CCOCCO)CC(CO)O.[Cl-] (ChemSpider) |
1 Chemical volume |
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Product name | Macvat-5 |
End use scenario | Personal care products - limited environmental release |
Or end use | Ointments |
Maximum end use concentration | 0.008 % |
Child or food contact | Neither |
Aerosolised during end use | No |
Any consumer end use | Yes |
No of items | Not entered |
Item unit weight | Not entered |
Product volume | 656 kg |
Precise proportion | 42% m/m 2,3-dihydroxy-[2-(2-hydroxy)ethyl]-[3-(2-hydroxy)propyl]-[(9Z,12Z)-octadeca-9,12-dienyl]azanium; chloride |
Chemical volume | 275.5 kg |
Introduction |
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Report ID | Not entered |
Exclusion | Not applicable |
Specified class | Not applicable |
Circumstances | Not applicable |
Introduction | Exempted - very low risk |
Total introduced | 275.5 kg |
Maximum concentration | 0.008 % |
Software revision | 0.9.60 |
1 Hazard |
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IC-R.S1.2.4.13 | IC-R.S1.2.4.13 Environmental pollutant: Aquatic: Industrial chemical (other than a polymer) that does not meet the criteria for ready biodegradability |
5 Useful links |
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AICIS assessment | https://www.industrialchemicals.gov.au/chemical-information/search-assessments?assessmentcasnumber=168677-75-6 |
AICIS CAS Number search | https://www.industrialchemicals.gov.au/search-inventory?casnumber=168677-75-6 If the CAS number is found this link will lead to the Inventory terms of listing. Otherwise it is most likely not listed |
AICIS checklist - Exempted - very low risk | https://www.industrialchemicals.gov.au/sites/default/files/2021-03/Exempted%20checklist%20-%20Highest%20indicative%20risk%20for%20your%20introduction%20is%20very%20low%20risk%20%5B522%20KB%5D.pdf The pdf file in this link will either download or display depending on your browser preferences |
AICIS Google search | https://www.google.com/search?q=168677-75-6+site%3A.industrialchemicals.gov.au Google search of the AICIS website for existing documents containing this CAS number |
AICIS record keeping obligations - Exempted - very low risk | https://www.industrialchemicals.gov.au/business/reporting-and-record-keeping-obligations/record-keeping-obligations-exempted-introductions/record-keeping-exempted-introductions-highest-indicative-risk-very-low |
6 Notes |
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Environment info required for AICIS: 08 Toxic to any aquatic life | 08 November 2021
Information on aquatic toxicity for all three trophic levels (fish, invertebrates and algae) from suitable in silico predictions on the chemical or in vivo studies on the chemical or from suitable read across information, conducted following acceptable test guidelines for aquatic toxicity, with the following results for all three trophic levels: - acute aquatic toxicity >10 mg/L (96 h LC50 (fish), or 48 h EC50 (invertebrates) or 72 or 96 h ErC50 (algae)), or - chronic aquatic toxicity NOEC or EC10 >1 mg/L (for chemicals that are not readily biodegradable), or
information that demonstrates that the chemical is a substance covered by Entry 9 of Annex V of the REACH Regulation
OECD Test 201: Freshwater Alga and Cyanobacteria, Growth Inhibition Test OECD Test 202: Daphnia sp. Acute Immobilisation Test OECD Test 203: Fish, Acute Toxicity Test OECD Test 210: Fish, Early-life Stage Toxicity Test OECD Test 211: Daphnia magna Reproduction Test |
Health info required for AICIS: 05 Genetic toxicity | 08 November 2021
Information that demonstrates the absence of mutagenic or genotoxic effects from both:
- information on the chemical or from suitable read across information that addresses gene mutations - this could be: * a suitable in silico prediction, both with and without metabolic activation, or * test results from a study conducted following an acceptable test guideline for gene mutations; and - test results from a study on the chemical or from suitable read across information conducted following an acceptable test guideline for chromosomal abnormalities.
OECD Test 471: Bacterial Reverse Mutation Test OECD Test 473: In Vitro Mammalian Chromosomal Aberration Test OECD Test 474: Mammalian Erythrocyte Micronucleus Test OECD Test 475: Mammalian Bone Marrow Chromosomal Aberration Test OECD Test 476: In Vitro Mammalian Cell Gene Mutation Tests using the Hprt and xprt genes OECD Test 478: Rodent Dominant Lethal Test OECD Test 485: Genetic toxicology, Mouse Heritable Translocation Assay OECD Test 486: Unscheduled DNA Synthesis (UDS) Test with Mammalian Liver Cells in vivo OECD Test 487: In Vitro Mammalian Cell Micronucleus Test OECD Test 488: Transgenic Rodent Somatic and Germ Cell Gene Mutation Assays OECD Test 489: In Vivo Mammalian Alkaline Comet Assay OECD Test 490: In Vitro Mammalian Cell Gene Mutation Tests Using the Thymidine Kinase Gene |
Health info required for AICIS: 10 Skin corrosion | 08 November 2021
A suitable in silico prediction indicating that the chemical is not irritating to skin or has no alerting groups for skin irritation |
Health info required for AICIS: 11 Eye damage | 08 November 2021
A suitable in silico prediction indicating that the chemical is not irritating to the eye |
Health info required for AICIS: 12 Skin sensitisation | 08 November 2021
Suitable in silico prediction indicating that the chemical and its metabolites (if any) do not cause skin sensitisation; and
results from an in vitro study on the chemical or from suitable read across information, conducted following an acceptable test guideline for the 2nd key event in skin sensitisation, with a nonsensitising prediction; and
test results from an in vitro study on the chemical or from suitable read across information, conducted following an acceptable test guideline for the 3rd key event in skin sensitisation, with a non-sensitising prediction
OECD Test 406: Skin Sensitisation OECD Test 429: Skin Sensitisation OECD Test 442A: Skin Sensitization OECD Test 442B: Skin Sensitization OECD Test 442C: In Chemico Skin Sensitisation OECD Test 442D: In Vitro Skin Sensitisation OECD Test 442E: In Vitro Skin Sensitisation |
Health info required for AICIS: 13 Acute toxicity (fatal or toxic) | 08 November 2021
Suitable in silico prediction for acute toxicity (LD50) of the chemical of >2,000 mg/kg bw/day; and
test results from an in vitro study on the chemical or from suitable read across information for acute toxicity (LD50), conducted following an acceptable test guideline for acute oral toxicity, of >300 mg/kg bw
OECD Test 420: Acute Oral Toxicity - Fixed Dose Procedure OECD Test 423: Acute Oral toxicity - Acute Toxic Class Method OECD Test 425: Acute Oral Toxicity: Up-and-Down Procedure |
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