4'-fluoro-4-[4-(o-methoxyphenyl)piperazin-1-yl]butyrophenone dihydrogen phosphate (CAS 1057-86-9) — formula C21H28FN2O6P, molecular weight 454.4; category organic chemicals.
| CAS Number | 1057-86-9 |
|---|---|
| Molecular Formula | C21H28FN2O6P |
| Molecular Weight | 454.4 |
| Category | Organic Chemicals |
4'-fluoro-4-[4-(o-methoxyphenyl)piperazin-1-yl]butyrophenone dihydrogen phosphate is a carbon-based organic compound with CAS registry number 1057-86-9 and molecular formula C21H28FN2O6P (molecular weight 454.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1057-86-9
Its molecular formula C21H28FN2O6P comprises 21 C, 28 H, 1 F, 2 N, 6 O, 1 P atoms.
Also known as: 4'-fluoro-4-[4-(o-methoxyphenyl)piperazin-1-yl]butyrophenone dihydrogen phosphate · 4'-氟-4-[4-(邻甲氧基苯基)哌嗪-1-基]丁酰苯磷酸二氢盐
Category: organic chemicals
The CAS registry number of 4'-fluoro-4-[4-(o-methoxyphenyl)piperazin-1-yl]butyrophenone dihydrogen phosphate is 1057-86-9.
Molecular formula C21H28FN2O6P, molecular weight 454.4.
It is also registered under: 4'-fluoro-4-[4-(o-methoxyphenyl)piperazin-1-yl]butyrophenone dihydrogen phosphate, 4'-氟-4-[4-(邻甲氧基苯基)哌嗪-1-基]丁酰苯磷酸二氢盐.
Category: Organic Chemicals.
Independent reference data for 4'-fluoro-4-[4-(o-methoxyphenyl)piperazin-1-yl]butyrophenone dihydrogen phosphate (CAS 1057-86-9), compiled from public chemistry databases.
| CAS 号 | 1057-86-9 |
|---|---|
| PubChem CID | 56842130 |
| 分子式 | C21H28FN2O6P |
| IUPAC 名称 | 1-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one;phosphoric acid |
| UNII（FDA） | NS00079990 |
| Molecular Weight | 454.4 |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 7 |
| Exact Mass | 454.16690178 |
| Monoisotopic Mass | 454.16690178 |
| Topological Polar Surface Area | 111 |
| Heavy Atom Count | 31 |
1057-86-9; EINECS 213-893-9; 4'-Fluoro-4-(4-(o-methoxyphenyl)piperazin-1-yl)butyrophenone dihydrogen phosphate; 4'-fluoro-4-[4-(o-methoxyphenyl)piperazin-1-yl]butyrophenone dihydrogen phosphate; ZOJCVJVTZBRZQU-UHFFFAOYSA-N; DTXSID701366123; NS00079990
4'-氟-4-[4-(邻甲氧基苯基)哌嗪-1-基]丁酰苯磷酸二氢盐 · CAS 1057-86-9 · C21H28FN2O6P. UNII NS00079990.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.