Substance Identity
CAS Number 111-84-2
Chemical Name Nonane
Type of substance Organic
SMILES C(CCCCCCC)C
Moiety of concern organic
Categorization Results

Meets Government of Canada Categorization Criteria? No
Meets Human Health Categorization Criteria? No
Meets Environmental Criteria for Categorization? No
Persistent (P)? No
Rational for P Category
Bioaccumulative (B)? No
Rational for B Category
Inherently Toxic to Aquatic Organisms (iT)? Yes
Rational for iT Experiment
DSL Quantity range (tonnes/year) >1000T

Ecological data supporting decisions

Underlying data regarding persistence

Media of concern leading to Categorization Air
Experimental Biodegradation half-life (days) Not Available
Predicted Ultimate degradation half-life (days) 8.67
MITI probability of biodegradation 0.8663
TOPKAT probability of biodegradation 1
EPI Predicted Ozone reaction half-life (days) 999
Experimental Atmospheric Oxidation half-life (days) 1.04847494553377
Reference (oxidation) ATKINSON,R.; KINETICS AND MECHANISMS OF THE GAS-PHASE REACTIONS OF THE HYDROXYL RADICAL WITH ORGANIC COMPOUNDS.; JOURNAL OF PHYSICAL AND CHEMICAL REFERENCE DATA. MONOGRAPH NO. 1.; 1989
Robust Study Summary (oxidation)
111842.doc
EPI Predicted Atmospheric Oxidation half-life (days) 1.103

Underlying data regarding Bioaccumulation

Log Kow predicted by KowWin 4.76
Log BAF T2MTL predicted by Gobas 3.8663041102543
Log BCF 5% T2LTL predicted by Gobas 3.45062466839924
Log BCF Max predicted by OASIS 4.03457726521322
Log BCF predicted by BCFWIN 1.966

Underlying data regarding inherent toxicity to aquatic organisms

Pivotal value for iT (mg/l) 0.2
Experimental result iT (mg/l) 0.2
Test species iT (Latin) Daphnia mag
Test species iT (Common) Water flea
Final EndPoint iT EC50
Exposure duration iT (hours) 48
Robust Study Summary iT
111-84-2_3576MSDS003e.doc
Toxicity to fathead minnow (LC50 in mg/l) as predicted by Topkat v6.1 0.2877
Toxicity to fish (LC50 in mg/l) as predicted by Ecosar v0.99g 0.242
Toxicity to fish (LC50 in mg/l) as predicted by Oasis Forecast M v1.10 1.0419
Toxicity to fish (LC50 in mg/l) as predicted by Aster 0.914481
Toxicity to fish (LC50 in mg/l) as predicted by PNN 6.98591
Toxicity to fish, daphnia, algae or mysid shrimp (EC50 or LC50 in mg/l) as predicted by Ecosar v0.99g 0.01
Chronic toxicity to daphnia or algae (EC50 in mg/l) as predicted by Ecosar v0.99g 0.054
Toxicity to fish (LC50 in mg/l) as predicted by Neutral Organics QSAR in Ecosar v0.99g 2.42E-001

Human Health data supporting decisions
Underlying data regarding potential for exposure

LPE/IPE/GPE Intermediate Potential for Exposure (HC Simple Exposure Tool)

Underlying data regarding Previous Assessments

Underlying data regarding Simple Hazard Assessment


Underlying data regarding Complex Hazard Assessment