3,5-dichlorophenol
fo-55b563fb55b48928
Identity
- Type
- Neutral molecule
- CAS
- 591-35-5
- EC
- 209-714-9
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
1- Phenol, 3,5-dichloro-
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | VPOMSPZBQMDLTM-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C6H4Cl2O/c7-4-1-5(8)3-6(9)2-4/h1-3,9H |
| IUPAC name chemrof:IUPAC_name | 3,5-dichlorophenol |
| Molecular formula chemrof:molecular_formula | C6H4Cl2O |
| Molecular mass chemrof:molecular_mass | 163.003 |
| Monoisotopic mass chemrof:monoisotopic_mass | 161.96392 |
| SMILES string chemrof:smiles_string | Oc1cc(Cl)cc(Cl)c1 |
Known URLs
16Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=591-35-5 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:88214 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.008.833 | enrich_references.pubchem_identifier_url |
| chemicalsafety.ilo.org | https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0440 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2025006 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=60649 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL314566 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/FG32L88KO9 | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0246051 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.689A | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/11571 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#2020 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/11278001 | enrich_references.chebi_xrefs |
| reaxys | reaxys:1906458 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q2355160 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/3,5-Dichlorophenol | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| c2b18a5d-c90d-4cd6-ae9b-68f64e8ff6d8 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 240eb6ad-0689-4228-a126-ad09e390fc00 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 7af11d46-f646-4a2d-8a55-8fdc355bbe66 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| f3de0a2e-3046-460c-b8df-e09f53418e7b | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| bda1c2c2-c9d5-473f-a330-be87331a0e2f | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 253fb172-25af-431a-8e4f-cee743d8e5b1 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| ab874a2e-dd9c-44f2-bf2b-ba8386fff6eb | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 7e3882ff-b2d7-4506-aa29-b3db87538670 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 017e9e52-7027-4007-9c73-d629f64eb27f | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| fc66b36a-87c6-4a94-b5c4-0bdbd3e92976 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 0f41018a-10c3-4d34-8487-cd60dde8295d | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| c43d3761-1d8c-4e3e-b83d-807d0154b634 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| fe2c8679-3db6-4033-9967-1576b3b59a24 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (54 changes)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works