Trixylyl Phosphate
fo-0eb9fc6efa15bfa6
Identity
- Type
- Molecular complex
- CAS
- 25155-23-1
- EC
- 246-677-8
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.
Alternative labels
13- Antiblaze TXP
- Coalite NTP
- Durad TXP
- Fyrquel L
- Phenol, dimethyl-, 1,1′,1′′-phosphate
- Phenol, dimethyl-, phosphate (3:1)
- Phosphoric acid trixylyl ester
- Trixylenyl phosphate
- TXP
- WSFR-TXP
- Xylenol, phosphate (3:1)
- Xylyl phosphate
- Xylyl phosphate ((C8H9O)3PO)
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | KOWVWXQNQNCRRS-UHFFFAOYSA-N, ZYVMOABEWBOSLY-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/3C8H10O.H3O4P/c3*1-6-4-3-5-8(9)7(6)2;1-5(2,3)4/h3*3-5,9H,1-2H3;(H3,1,2,3,4), InChI=1S/C24H27O4P/c1-16-7-10-22(19(4)13-16)26-29(25,27-23-11-8-17(2)14-20(23)5)28-24-12-9-18(3)15-21(24)6/h7-15H,1-6H3 |
| IUPAC name chemrof:IUPAC_name | phosphoric acid tris(2,4-dimethylphenyl) ester, phosphoric acid;tris(2,3-xylenol), tris(2,3-dimethylphenol);phosphoric acid, tris(2,4-dimethylphenyl) phosphate |
| Molecular formula chemrof:molecular_formula | C24H27O4P, C24H33O7P |
| SMILES string chemrof:smiles_string | CC1=C(C(=CC=C1)O)C.CC1=C(C(=CC=C1)O)C.CC1=C(C(=CC=C1)O)C.OP(=O)(O)O, CC1=CC(=C(C=C1)OP(=O)(OC2=C(C=C(C=C2)C)C)OC3=C(C=C(C=C3)C)C)C |
Known URLs
12Where 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=25155-23-1 | enrich_references.consensus_cas_link |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=3862-12-2 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.042.419 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.181.429 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID80959466 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=78488 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5TL8H5QK8V | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J173.955G | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/122197630 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/19736 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#3082 | enrich_references.pubchem_identifier_url |
| wikidata.org | https://www.wikidata.org/wiki/Q98425917 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 9a1798ee-e79d-4e59-a2a4-4c77158dc7e0 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 04fa2fbd-5989-41d1-b021-925e154d5278 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| a3e4a5ca-a388-4a25-8099-582d522785d6 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 7efc5bdd-1e60-49e5-8646-df404438fd2d | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 7742f875-b8c0-4ef3-ba59-4b69390a25fd | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| aeea31c0-cf54-49d5-887c-f3a3def6965d | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 04c57ede-8e39-422c-b5ae-14a943e57aaf | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 50d2c807-7582-4b36-8a4c-9dada4adf678 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 468f3fc2-ba6a-4be5-b2c1-20f9de080695 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| fdd1fbec-f1d0-4c59-9786-7b0877d05116 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 2e0c0704-d751-4b10-9b97-fa259d8ad488 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| ed3430de-61de-4266-b4ae-d103dc28ca31 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 565b9907-7504-4834-8478-9bc2ee6f8c9d | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (55 changes)
Full record
Flow object JSON
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