Tris(11-methyldodecyl) Benzene-1,2,4-tricarboxylate
fo-9ffb002244263393
Identity
- Type
- Neutral molecule
- CAS
- 72361-35-4
- EC
- 276-594-2
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
2- 1,2,4-Benzenetricarboxylic acid, 1,2,4-triisotridecyl ester
- 1,2,4-Benzenetricarboxylic acid, triisotridecyl ester
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | IGQFKXMQIMEIJV-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C48H84O6/c1-40(2)31-25-19-13-7-10-16-22-28-36-52-46(49)43-34-35-44(47(50)53-37-29-23-17-11-8-14-20-26-32-41(3)4)45(39-43)48(51)54-38-30-24-18-12-9-15-21-27-33-42(5)6/h34-35,39-42H,7-33,36-38H2,1-6H3 |
| IUPAC name chemrof:IUPAC_name | Tris(11-methyldodecyl) Benzene-1,2,4-tricarboxylate |
| Molecular formula chemrof:molecular_formula | C48H84O6 |
| Molecular mass chemrof:molecular_mass | 757.194 |
| Monoisotopic mass chemrof:monoisotopic_mass | 756.62679 |
| SMILES string chemrof:smiles_string | CC(C)CCCCCCCCCCOC(=O)c1ccc(C(=O)OCCCCCCCCCCC(C)C)c(C(=O)OCCCCCCCCCCC(C)C)c1 |
Known URLs
5Where 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=72361-35-4 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.069.610 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J447.147D | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/175037 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q82000675 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 3ebaeef7-5037-455b-9bb6-3871a32aa3f3 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| ce22aa5f-f3b1-476d-a5c5-33d50de71452 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| fed82b40-3ccb-4ff7-ac4d-b7c23422c785 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| ad5242b1-a32d-4088-9a97-04c73087b6ab | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| e4d59c5b-90cb-4f9e-83fa-158f7be4cd12 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 37eb9fe6-46e2-4f62-870a-7b31b817faa5 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| fbfa6495-406e-4f33-8277-6f9f6cd1ac99 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 3d9d3f5e-ee3b-4dc4-8a3d-98d689625f52 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 8b90c89b-583a-40f9-ae7d-384a617b34f1 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 6810e927-2e08-4d95-8c98-a57d26704b5d | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| a7c7c11f-156a-42b8-b91a-77a30aca154a | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 86b42920-0743-4a3c-a587-f2027b7842bf | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 2c0fe15b-0d83-4ed8-b674-768f4c90972f | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (54 changes)
Full record
Flow object JSON
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}Something wrong here?
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- 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