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add toxic organics, #202
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@bl-young
bl-young committed Nov 6, 2024
1 parent ceb8c2b commit 423400e
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33 changes: 33 additions & 0 deletions fedelemflowlist/input/ChemicalsFlowablePrimaryContexts.csv
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Expand Up @@ -15049,3 +15049,36 @@ Diflufenzopyr,Emission,Water
Dibutyltin,Emission,Water
Ammonium sulfate,Emission,Water
Octaethylene glycol monododecyl ether,Emission,Air
2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide,Emission,Ground
2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide,Emission,Water
"(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid",Emission,Water
"(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid",Emission,Ground
"1-(6-tert-butyl-1,1-dimethyl-2,3-dihydroinden-4-yl)ethanone",Emission,Ground
"1-(6-tert-butyl-1,1-dimethyl-2,3-dihydroinden-4-yl)ethanone",Emission,Water
2-(4-chlorophenoxy)-2-methylpropanoic acid,Emission,Water
2-(4-chlorophenoxy)-2-methylpropanoic acid,Emission,Ground
"2,2-dichloroacetaldehyde",Emission,Water
"4,6,6,7,8,8-hexamethyl-1,3,4,7-tetrahydrocyclopenta[g]isochromene",Emission,Ground
"4,6,6,7,8,8-hexamethyl-1,3,4,7-tetrahydrocyclopenta[g]isochromene",Emission,Water
"(4R,4aR,7aR,12bS)-9-methoxy-3-methyl-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one",Emission,Ground
"(4R,4aR,7aR,12bS)-9-methoxy-3-methyl-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one",Emission,Water
[2-(carbamoyloxymethyl)-2-methylpentyl] carbamate,Emission,Water
[2-(carbamoyloxymethyl)-2-methylpentyl] carbamate,Emission,Ground
"1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethanone",Emission,Water
"1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethanone",Emission,Ground
(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid,Emission,Ground
(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid,Emission,Water
"(3R,5R)-7-[2-(4-fluorophenyl)-4-[(2-hydroxyphenyl)carbamoyl]-3-phenyl-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid",Emission,Water
"(3R,5R)-7-[2-(4-fluorophenyl)-4-[(2-hydroxyphenyl)carbamoyl]-3-phenyl-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid",Emission,Ground
(2-hydroxy-4-methoxyphenyl)-phenylmethanone,Emission,Water
(2-hydroxy-4-methoxyphenyl)-phenylmethanone,Emission,Ground
"1-(1,1,2,3,3,6-hexamethyl-2H-inden-5-yl)ethanone",Emission,Ground
"1-(1,1,2,3,3,6-hexamethyl-2H-inden-5-yl)ethanone",Emission,Water
"(3R,5R)-7-[2-(4-fluorophenyl)-4-[(4-hydroxyphenyl)carbamoyl]-3-phenyl-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid",Emission,Ground
"(3R,5R)-7-[2-(4-fluorophenyl)-4-[(4-hydroxyphenyl)carbamoyl]-3-phenyl-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid",Emission,Water
"(8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one",Emission,Ground
"(8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one",Emission,Water
"1-(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)ethanone",Emission,Water
"1-(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)ethanone",Emission,Ground
3-[bis(2-carboxyethyl)phosphanyl]propanoic acid,Emission,Ground
3-[bis(2-carboxyethyl)phosphanyl]propanoic acid,Emission,Water
17 changes: 17 additions & 0 deletions fedelemflowlist/input/ChemicalsFlowables.csv
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Expand Up @@ -5819,3 +5819,20 @@ Diflufenzopyr,109293-97-2,C15H12F2N4O3,,kg,https://pubchem.ncbi.nlm.nih.gov/comp
Dibutyltin,1002-53-5,C8H18Sn,,kg,https://pubchem.ncbi.nlm.nih.gov/compound/6484,0
Ammonium sulfate,7783-20-2,H8N2O4S,diammonium sulfate diazanium,kg,https://pubchem.ncbi.nlm.nih.gov/compound/6097028,0
Octaethylene glycol monododecyl ether,3055-98-9,C28H58O9,,kg,https://pubchem.ncbi.nlm.nih.gov/compound/123921,0
2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide,29122-68-7,,atenolol,kg,,0
"(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid",134523-00-5,,atorvastatin,kg,,0
"1-(6-tert-butyl-1,1-dimethyl-2,3-dihydroinden-4-yl)ethanone",13171-00-1,,celestolide,kg,,0
2-(4-chlorophenoxy)-2-methylpropanoic acid,882-09-7,,clofibric acid,kg,,0
"2,2-dichloroacetaldehyde",79-02-7,,dichloroacetaldehyde,kg,,0
"4,6,6,7,8,8-hexamethyl-1,3,4,7-tetrahydrocyclopenta[g]isochromene",1222-05-5,,galaxolide,kg,,0
"(4R,4aR,7aR,12bS)-9-methoxy-3-methyl-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one",50678-79-0,,hydrocodone,kg,,0
[2-(carbamoyloxymethyl)-2-methylpentyl] carbamate,57-53-4,,meprobamate,kg,,0
"1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethanone",81-14-1,,musk ketone,kg,,0
(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid,22204-53-1,,naproxen,kg,,0
"(3R,5R)-7-[2-(4-fluorophenyl)-4-[(2-hydroxyphenyl)carbamoyl]-3-phenyl-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid",214217-86-4,,o-hydroxy atorvastatin,kg,,0
(2-hydroxy-4-methoxyphenyl)-phenylmethanone,131-57-7,,oxybenzone,kg,,0
"1-(1,1,2,3,3,6-hexamethyl-2H-inden-5-yl)ethanone",15323-35-0,,phantolide,kg,,0
"(3R,5R)-7-[2-(4-fluorophenyl)-4-[(4-hydroxyphenyl)carbamoyl]-3-phenyl-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid",214217-88-6,,p-hydroxy atorvastatin,kg,,0
"(8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one",57-83-0,,progesterone,kg,,0
"1-(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)ethanone",21145-77-7,,tonalide,kg,,0
3-[bis(2-carboxyethyl)phosphanyl]propanoic acid,5961-85-3,,tris(2-carboxyethyl)phosphine,kg,,0

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