1-(4,8-bis-(2,2,2-trifluoroacetyl)-11-{4-[4,8,11-tris-(2,2,2-trifluoroacetyl)-1,4,8,11-tetraazacyclotetradec-1-ylMethyl]-benzyl}-1,4,8,11-tetraazacyclotetradec-1-yl)-2,2,2-trifluoroethanone (CAS 406939-93-3) — formula C40H48F18N8O6, molecular weight 1078.8; category organic chemicals.
| CAS Number | 406939-93-3 |
|---|---|
| Molecular Formula | C40H48F18N8O6 |
| Molecular Weight | 1078.8 |
| LogP | 6.3 |
| Category | Organic Chemicals |
1-(4,8-bis-(2,2,2-trifluoroacetyl)-11-{4-[4,8,11-tris-(2,2,2-trifluoroacetyl)-1,4,8,11-tetraazacyclotetradec-1-ylMethyl]-benzyl}-1,4,8,11-tetraazacyclotetradec-1-yl)-2,2,2-trifluoroethanone is a carbon-based organic compound with CAS registry number 406939-93-3 and molecular formula C40H48F18N8O6 (molecular weight 1078.8), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 406939-93-3
Its molecular formula C40H48F18N8O6 comprises 40 C, 48 H, 18 F, 8 N, 6 O atoms.
Also known as: 1-(4,8-bis-(2,2,2-trifluoroacetyl)-11-{4-[4,8,11-tris-(2,2,2-trifluoroacetyl)-1,4,8,11-tetraazacyclotetradec-1-ylMethyl]-benzyl}-1,4,8,11-tetraazacyclotetradec-1-yl)-2,2,2-trifluoroethanone · 普乐沙福杂质P
Category: organic chemicals
The CAS registry number of 1-(4,8-bis-(2,2,2-trifluoroacetyl)-11-{4-[4,8,11-tris-(2,2,2-trifluoroacetyl)-1,4,8,11-tetraazacyclotetradec-1-ylMethyl]-benzyl}-1,4,8,11-tetraazacyclotetradec-1-yl)-2,2,2-trifluoroethanone is 406939-93-3.
Molecular formula C40H48F18N8O6, molecular weight 1078.8.
It is also registered under: 1-(4,8-bis-(2,2,2-trifluoroacetyl)-11-{4-[4,8,11-tris-(2,2,2-trifluoroacetyl)-1,4,8,11-tetraazacyclotetradec-1-ylMethyl]-benzyl}-1,4,8,11-tetraazacyclotetradec-1-yl)-2,2,2-trifluoroethanone, 普乐沙福杂质P.
Category: Organic Chemicals.
Independent reference data for 1-(4,8-bis-(2,2,2-trifluoroacetyl)-11-{4-[4,8,11-tris-(2,2,2-trifluoroacetyl)-1,4,8,11-tetraazacyclotetradec-1-ylMethyl]-benzyl}-1,4,8,11-tetraazacyclotetradec-1-yl)-2,2,2-trifluoroethanone (CAS 406939-93-3), compiled from public chemistry databases.
| CAS 号 | 406939-93-3 |
|---|---|
| PubChem CID | 11309252 |
| 分子式 | C40H48F18N8O6 |
| IUPAC 名称 | 1-[4,8-bis(2,2,2-trifluoroacetyl)-11-[[4-[[4,8,11-tris(2,2,2-trifluoroacetyl)-1,4,8,11-tetrazacyclotetradec-1-yl]methyl]phenyl]methyl]-1,4,8,11-tetrazacyclotetradec-1-yl]-2,2,2-trifluoroethanone |
| UNII（FDA） | WQ5F9W426N |
| Molecular Weight | 1078.8 |
|---|---|
| XLogP3 | 6.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 26 |
| Rotatable Bond Count | 4 |
| Exact Mass | 1078.3409382 |
| Monoisotopic Mass | 1078.3409382 |
| Topological Polar Surface Area | 128 |
| Heavy Atom Count | 72 |
Plerixafor Hexa(trifluoroacetate); 4069393-93-3; 406939-93-3; Plerixafor Hexatrifluoroacetamide; Plerixafor Impurity P; Plerixafor Hexa(Trifluoroacetic Acid Salt); ZLIVMLGSJBPBRC-UHFFFAOYSA-N; AGN-PC-006HWZ; WQ5F9W426N; SCHEMBL15963227; DTXSID00461834; 1,4,8,11-Tetraazacyclotetradecane, 1,1'-[1,4-phenylenebis(methylene)]bis[4,8,11-tris(trifluoroacetyl)-
普乐沙福杂质P · CAS 406939-93-3 · C40H48F18N8O6. UNII WQ5F9W426N.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 普乐沙福杂质P