3,3'-(1,4-phenylene)bis(5,6-diphenyl-1,2,4-triazine)
fo-72dd2c0cbaac85e2
Identity
- Type
- Neutral molecule
- CAS
- 55514-22-2
- EC
- 700-823-1
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 53 across every transformer
Structure
Alternative labels
4- 1,2,4-Triazine, 3,3′-(1,4-phenylene)bis[5,6-diphenyl-
- 3,3′-(1,4-Phenylene)bis[5,6-diphenyl-1,2,4-triazine]
- 5,6,5′,6′-Tetraphenyl-3,3 ′-(1,4-phenylene)-bis[1,2,4]triazine
- TriAsorB
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | NZTWOIMQWMZIRE-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C36H24N6/c1-5-13-25(14-6-1)31-33(27-17-9-3-10-18-27)39-41-35(37-31)29-21-23-30(24-22-29)36-38-32(26-15-7-2-8-16-26)34(40-42-36)28-19-11-4-12-20-28/h1-24H |
| IUPAC name chemrof:IUPAC_name | 3,3'-(1,4-phenylene)bis(5,6-diphenyl-1,2,4-triazine) |
| Molecular formula chemrof:molecular_formula | C36H24N6 |
| Molecular mass chemrof:molecular_mass | 540.63 |
| Monoisotopic mass chemrof:monoisotopic_mass | 540.206245 |
| SMILES string chemrof:smiles_string | c1ccc(-c2nnc(-c3ccc(-c4nnc(-c5ccccc5)c(-c5ccccc5)n4)cc3)nc2-c2ccccc2)cc1 |
Known URLs
6Where 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=55514-22-2 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.221.151 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID601045085 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.571.337B | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/59516799 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q126605545 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| ac8b20ce-dc9b-4ed1-be9f-469925bf06f0 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 078a8b9a-5345-493d-ad41-065d7f4e4393 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 1082622c-32d9-4c87-9c16-b1db7c8d2855 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 7658356d-f86c-444d-b7a9-ee498a21d61c | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 4d267643-2c14-400a-bf37-8254d681fb58 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 1e38ae72-2670-4317-bb2a-96ae4231792c | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| eda93b68-2c93-4b6d-ae10-66ccf4e53b08 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| e484aebb-526d-434b-ac63-38590ac5736b | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| c489c3a0-cb7d-4e36-91e8-09e4ff26becb | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 31869617-380e-44f9-9383-676326fbe537 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| e107a562-0148-4656-b43e-2e1cb843fbaa | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 0d8e1dc5-14a3-4925-8046-df9848fe42ad | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| ef3159ce-e804-4c20-869d-cc8a3f61529b | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (53 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