Diclofenac
93c8309f-80f7-4b9f-8b3f-8a80a971fe6e
Identity
- Substance
- fo-edd28969e25bbe6b Neutral molecule
- Source
- EF 3.1
- Unit
- kg
- Context
- Environmental → Air → Indoor
- CAS
- 15307-86-5
- EC
- 239-348-5
Context
- Dimension
- Environmental
- Indoor
- Unknown
- Media
- Air
Alternative labels
32- 2-((2,6-dichlorophenyl)amino)benzeneacetic acid
- 2-[(2,6-dichlorophenyl)amino]benzeneacetic acid
- [2-(2,6-dichloroanilino)phenyl]acetic acid
- diclofenac acid
- diclofenaco
- diclofenacum
- diclofenamic acid
- {2-[(2,6-dichlorophenyl)amino]phenyl}acetic Acid
- 2-(2,6-Dichloroanilino)phenylacetic acid
- 2-(2,6-Dichlorophenylamino)phenylacetic acid
- 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid
- 2-[2-(2,6-Dichlorophenylamino)phenyl]acetic acid
- N-(2,6-Dichlorophenyl)-o-aminophenylacetic acid
- Acetic acid, [o-(2,6-dichloroanilino)phenyl]-
- Benzeneacetic acid, 2-[(2,6-dichlorophenyl)amino]-
- Dichlofenac
- Diclac
- Dicloftil
- Diclomelan
- Dicloreuma
- Flector
- Flector EP Tissugel
- MeSH ID: D004008
- Ortofen
- Pennsaid
- Transfenac
- Vetagesic
- Voltaflan
- Voltaren Dolo
- Zolterol
- Zorvolex
- [o-(2,6-Dichloroanilino)phenyl]acetic acid
Source lists
1| List | Version | Source flow | Name there | Why this flow |
|---|---|---|---|---|
| EF | 3.1 | 93c8309f-80f7-4b9f-8b3f-8a80a971fe6e | {2-[(2,6-dichlorophenyl)amino]phenyl}acetic acid | The consensus list is built from this one, so this row is the flow itself rather than something matched to it. |
Concept associations
1| Source list | Source flow | Name there | Compartment there | Match | Conversion |
|---|---|---|---|---|---|
| EF 3.1 | 93c8309f-80f7-4b9f-8b3f-8a80a971fe6e | {2-[(2,6-dichlorophenyl)amino]phenyl}acetic acid | Emissions/Emissions to air/Emissions to air, indoor | exactMatch | — |
Characterisation factors
12- consensus-flow-list 6 (4 non-zero)
- European Commission — JRC 6 (4 non-zero)
Every implementation that says anything about this flow. Published as is what this list did with the row: where more than one implementation states a number and they agree it publishes it as agreed; where only one speaks, as sole; where they disagree it publishes nothing and asks.
| Method | Implementation | Category | Place | Factor | Published as |
|---|---|---|---|---|---|
| EF 3.1 | European Commission — JRC | Ecotoxicity, freshwater | — | 184.55 | — |
| EF 3.1 | consensus-flow-list | Ecotoxicity, freshwater | — | 184.55 | sole |
| EF 3.1 | European Commission — JRC | Ecotoxicity, freshwater_organics | — | 184.55 | — |
| EF 3.1 | consensus-flow-list | Ecotoxicity, freshwater_organics | — | 184.55 | sole |
| EF 3.1 | European Commission — JRC | Human toxicity, cancer | — | 0 | — |
| EF 3.1 | consensus-flow-list | Human toxicity, cancer | — | 0 | sole |
| EF 3.1 | European Commission — JRC | Human toxicity, cancer_organics | — | 0 | — |
| EF 3.1 | consensus-flow-list | Human toxicity, cancer_organics | — | 0 | sole |
| EF 3.1 | European Commission — JRC | Human toxicity, non-cancer | — | 3.5041e-04 | — |
| EF 3.1 | consensus-flow-list | Human toxicity, non-cancer | — | 3.5041e-04 | sole |
| EF 3.1 | European Commission — JRC | Human toxicity, non-cancer_organics | — | 3.5041e-04 | — |
| EF 3.1 | consensus-flow-list | Human toxicity, non-cancer_organics | — | 3.5041e-04 | sole |
History
The change log and the PROV-O trail (4 consensus changes)
These are the heaviest sections of this page and the least often read, so the page does not pay for them until you ask.
Full record
Flow JSON
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Something wrong here?
A flow can be wrong in three ways, and they are decided differently. Pick the one that matches what you are looking at.
- A row from my list should not reach this flow
- This flow is not that chemical
- The compartment or the unit is wrong
- One of these characterisation factors cannot be this substance's
You do not need to run a build or clone anything. Name the row and say what your evidence is; the measurement is done for you. How contributing works