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. 2017 Apr 19;12(4):e0175344. doi: 10.1371/journal.pone.0175344

Table 4. Chemicals used in routine oil and gas development that are classified by the United Nations Globally Harmonized System (GHS) in Categories 1 and 2 for ecotoxicitya.

Chemical name CASRN Water Fleab Fathead Minnowc Rainbow Troutd Green Algaee Frequency of use (% events) Median mass per event (kg)
1,2,3-Trimethylbenzene 526-73-8 - - - 2 0.3% 1.0
1,2,4-Trimethylbenzene 95-63-6 2 2 - 2 5.7% 1.6
1,3,5-Trimethylbenzene 108-67-8 2 - - 2 0.3% 2.3
2-Mercaptoethyl alcohol 60-24-2 2 - - 2 0.7% 2.5
2-Methyl-3(2H)-isothiazolone 2682-20-4 1 - 1 1 0.2% 2.6
5-Chloro-2-methyl-3(2H)-isothiazolone 26172-55-4 1 - 1 1 0.1% 5.2
Acrylamide 79-06-1 3 >3 >3 1 0.8% <0.1
Alcohols, C10-14, ethoxylated 66455-15-0 - - - 1 0.6% 64
Aluminum 7429-90-5 - - 1 - 16.5% 9.1
Ammonium chloride 12125-02-9 >3 2 >3 - 48.4% 454
Benzene, c10-c16 alkyl derivatives 68648-87-3 - - - 1 0.9% <0.1
Benzene, tetrapropylene- 25265-78-5 - - - 1 0.1% 2.7
Benzoisothiazolinone 2634-33-5 1 - 1 1 0.1% <0.1
Bis(isopropyl)naphthalene 38640-62-9 - - - 1 2.0% 1.8
Canola oil 120962-03-0 - - - 1 0.3% 92
Cocamidopropyl betaine 61789-40-0 2 - - >3 0.7% <0.1
Cyclohexasiloxane, 2,2,4,4,6,6,8,8,10,10,12,12-dodecamethyl- 540-97-6 - - - 1 0.3% <0.1
Cyclopentasiloxane, 2,2,4,4,6,6,8,8,10,10-decamethyl- 541-02-6 - - - 1 0.3% <0.1
DBNPA (2,2-dibromo-3-nitrilopropionamide) 10222-01-2 1 1 1 1 0.3% 4.1
Dodecylbenzene 123-01-3 - - - 1 0.1% 5.4
Dodecylbenzene sulfonic acid 27176-87-0 2 - 2 3 1.4% <0.1
Ethanesulfonic acid, 2-[methyl[(9z)-1-oxo-9-octadecen-1-yl]amino]-, sodium salt (1:1) 137-20-2 - - - 2 0.6% 53
Ethoxylated C14-15 alcohols 68951-67-7 1 1 1 1 1.3% 2.4
Ethoxylated hexanol 68439-45-2 2 - 2 >3 0.3% 16
Ethylbenzene 100-41-4 2 2 2 2 31.3% 2.9
Fatty acids, tall-oil 61790-12-3 >3 - - 1 0.4% 7.1
Fatty acids, tall-oil, reaction products with triethanolamine 67784-78-5 - - - 2 1.3% <0.1
Ferric chloride 7705-08-0 2 3 - - 0.5% 30
Glutaraldehyde 111-30-8 1 2 2 2 23.1% 75
Glyoxal 107-22-2 >3 >3 0 2 23.0% 3.6
Hydrochloric acid 7647-01-0 1 - 2 - 54.8% 1,311
Hydrotreated light petroleum distillate 64742-47-8 - 3 2 1 32.9% 17
Isopropylbenzene 98-82-8 3 2 2 2 29.5% 0.3
Lecithins 8002-43-5 - - - 1 0.3% 1.4
Lithium hypochlorite 13840-33-0 1 - 1 - 0.2% 129
Naphtha (petroleum), heavy catalytic reformed 64741-68-0 - - - 2 0.2% 18
Naphthalene 91-20-3 1 1 1 2 48.4% 0.3
Octamethylcyclotetrasiloxane 556-67-2 - - - 1 0.3% <0.1
Petroleum distillate-mineral oil grade 8002-05-9 1 - - 1 0.1% 30
Petroleum distillates 64741-44-2 - - - 1 0.1% 138,679
Petroleum distillates 64742-46-7 - - - 1 0.1% 138,679
Poly(oxy-1,2-ethandiyl), a-(nonylphenyl)-w-hydroxy- 9016-45-9 2 - 2 2 13.2% 4.6
Polyethylene glycol monostearate 9004-99-3 - - - 1 1.3% <0.1
Polypropylene 9003-07-0 - - - 1 1.1% 56
Polysiloxanes, di-Me 63148-62-9 3 - - 1 1.6% <0.1
Propargyl alcohol 107-19-7 - 2 - >3 53.8% 3.7
Quinoline 91-22-5 3 1 - 3 18.8% 0.1
Sodium chloroacetate 3926-62-3 >3 - - 1 0.3% <0.1
Sodium hypochlorite 7681-52-9 1 1 1 >3 0.2% 2.3
Sodium silicate 1344-09-8 1 - - - 0.7% 72
Solvent naphtha, petroleum, heavy arom. 64742-94-5 1 3 2 2 39.0% 1.8
Solvent naphtha, petroleum, light arom. 64742-95-6 2 - 2 2 5.8% 1.7
Sorbitan monostearate 1338-41-6 - - - 1 1.3% <0.1
Stearic acid 57-11-4 - - - 1 12.1% 150
Sulfonic acids, c14-16-alkane hydroxy and c14-16-alkene, sodium salts 68439-57-6 2 - - 3 0.1% 5.4
Tall oil 8002-26-4 - - - 1 0.8% 13
Xylenes 1330-20-7 - 3 2 2 32.0% 1.5
Zinc sulfate 7733-02-0 1 1 1 - 0.2% 50

aOnly chemicals with valid CASRN could be evaluated.

bDaphnia magna

cPimephales promelas

dOncorhynchus mykiss

ecomputational estimates from EPI Suite.