TRI-N-HEXYLTRIMELLITATE (CAS 1528-49-0) — formula C27H42O6, molecular weight 462.6; category organic chemicals.
| CAS Number | 1528-49-0 |
|---|---|
| Molecular Formula | C27H42O6 |
| Molecular Weight | 462.6 |
| LogP | 8.5 |
| Category | Organic Chemicals |
TRI-N-HEXYLTRIMELLITATE is a carbon-based organic compound with CAS registry number 1528-49-0 and molecular formula C27H42O6 (molecular weight 462.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1528-49-0
Its molecular formula C27H42O6 comprises 27 C, 42 H, 6 O atoms.
Also known as: TRI-N-HEXYLTRIMELLITATE · 偏苯三酸三正己酯
Category: organic chemicals
The CAS registry number of TRI-N-HEXYLTRIMELLITATE is 1528-49-0.
Molecular formula C27H42O6, molecular weight 462.6.
It is also registered under: TRI-N-HEXYLTRIMELLITATE, 偏苯三酸三正己酯.
Category: Organic Chemicals.
Independent reference data for TRI-N-HEXYLTRIMELLITATE (CAS 1528-49-0), compiled from public chemistry databases.
| CAS Registry Number | 1528-49-0 |
|---|---|
| PubChem CID | 73718 |
| Molecular formula | C27H42O6 |
| IUPAC name | trihexyl benzene-1,2,4-tricarboxylate |
| UNII (FDA) | NS00024976 |
| Molecular Weight | 462.6 |
|---|---|
| XLogP3 | 8.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 21 |
| Exact Mass | 462.29813906 |
| Monoisotopic Mass | 462.29813906 |
| Topological Polar Surface Area | 78.9 |
| Heavy Atom Count | 33 |
| Collision Cross Section | 236.57 Ų [M+H]+ |
|---|---|
| Collision Cross Section | 247.49 Ų [M+Na]+ |
1528-49-0; Trihexyl benzene-1,2,4-tricarboxylate; Trihexyl trimellitate; 1,2,4-BENZENETRICARBOXYLIC ACID, TRIHEXYL ESTER; EINECS 216-208-1; 1,2,4-Benzenetricarboxylic acid, 1,2,4-trihexyl ester; DTXSID4052681; RefChem:899638; DTXCID7031325; 216-208-1; TRI-N-HEXYLTRIMELLITATE; Tri-n-hexyl trimellitate; Morflex 560; THTM; Morflex(R) 560; SCHEMBL444272
| GHS notification summary | 97.5% (78 / 80) |
|---|
| GHS notification summary | 97.5% (78 / 80) |
|---|
This chemical does not meet GHS hazard criteria for 97.5% (78 of 80) of all reports.
Reported as not meeting GHS hazard criteria by 78 of 80 companies (only 2.5% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
TRI-N-HEXYLTRIMELLITATE · CAS 1528-49-0 · C27H42O6. UNII NS00024976. Collision Cross Section: 236.57 Ų [M+H]+; Collision Cross Section: 247.49 Ų [M+Na]+.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 偏苯三酸三正己酯