Bemotrizinol
fo-e3bce30843f61b56
Identity
- Type
- Neutral molecule
- CAS
- 187393-00-6
- EC
- 425-950-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 58 across every transformer
Structure
Alternative labels
12- 2,2′-[6-(4-Methoxyphenyl)-1,3,5-triazine-2,4-diyl]bis[5-[(2-ethylhexyl)oxy]phenol]
- 2,4-Bis[4-(2-ethylhexyloxy)-2-hydroxyphenyl]-6-(4-methoxyphenyl)-1,3,5-triazine
- BEMT
- Cgf-c 1607
- Escalol S
- FAT 70′884
- Neo Heliopan BMT
- Parsol Shield
- Phenol, 2,2′-[6-(4-methoxyphenyl)-1,3,5-triazine-2,4-diyl]bis[5-[(2-ethylhexyl)oxy]-
- Tianlaisch S
- Tinosorb S
- Tinosorb S Aqua
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | XVAMCHGMPYWHNL-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C38H49N3O5/c1-6-10-12-26(8-3)24-45-30-18-20-32(34(42)22-30)37-39-36(28-14-16-29(44-5)17-15-28)40-38(41-37)33-21-19-31(23-35(33)43)46-25-27(9-4)13-11-7-2/h14-23,26-27,42-43H,6-13,24-25H2,1-5H3 |
| IUPAC name chemrof:IUPAC_name | 2,2′-[6-(4-Methoxyphenyl)-1,3,5-triazine-2,4-diyl]bis[5-[(2-ethylhexyl)oxy]phenol] |
| Molecular formula chemrof:molecular_formula | C38H49N3O5 |
| Molecular mass chemrof:molecular_mass | 627.826 |
| Monoisotopic mass chemrof:monoisotopic_mass | 627.36722, 627.367222 |
| SMILES string chemrof:smiles_string | CCCCC(CC)COc1ccc(-c2nc(-c3ccc(OC)cc3)nc(-c3ccc(OCC(CC)CCCC)cc3O)n2)c(O)c1 |
Known URLs
21Where 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=187393-00-6 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:135857 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.102.441 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.109.468 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.207.803 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID40896984 | enrich_references.pubchem_identifier_url |
| drugbank.ca | https://www.drugbank.ca/drugs/DB11206 | enrich_references.pubchem_identifier_url |
| drugcentral | drugcentral:3014 | enrich_references.chebi_xrefs |
| drugcentral.org | https://drugcentral.org/drugcard/3014 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=759870 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2104956 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/PWZ1720CBH | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.824.435G | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.006.203E | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D03227 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=152505 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C74398 | enrich_references.pubchem_identifier_url |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL2104956 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/135487856 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q4885134 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Bemotrizinol | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 3a06728e-6c0d-4f48-99bb-55ab5375029f | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 50658195-813e-4480-833a-c40316fb1ec7 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 3c10cc69-333c-41ae-9409-bbd211e78803 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| effe149a-a188-48cc-9a1a-876f03f551e0 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 5645754c-d42e-449b-930e-e6c21e61056d | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| c658d4a3-addb-4e64-9a8a-e9569c8edf14 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 9090634e-0816-4d90-9223-1e377d479e73 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 98b81714-f827-4ce4-890f-d059c5639b66 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| ee318db2-1234-41cb-af43-6c8224a23953 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 792ec4e0-f30d-4b7a-bbbd-16ea49fc8f4c | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| b6d7240c-f122-484c-a81c-9f18a90815e8 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 190e8b85-3919-46c3-8838-8880b8e04831 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| bcd2d6e1-93ac-40d0-9484-e9edb76ee2bd | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (58 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