ethyl 3-(4-bromophenyl)-7-hydroxy-4-oxo-4H-chromene-2-carboxylate (CAS 96644-14-3) — formula C18H13BrO5, molecular weight 389.2; category organic chemicals.
| CAS Number | 96644-14-3 |
|---|---|
| Molecular Formula | C18H13BrO5 |
| Molecular Weight | 389.2 |
| LogP | 3.9 |
| Category | Organic Chemicals |
ethyl 3-(4-bromophenyl)-7-hydroxy-4-oxo-4H-chromene-2-carboxylate is a carbon-based organic compound with CAS registry number 96644-14-3 and molecular formula C18H13BrO5 (molecular weight 389.2), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96644-14-3
Its molecular formula C18H13BrO5 comprises 18 C, 13 H, 1 Br, 5 O atoms.
Also known as: ethyl 3-(4-bromophenyl)-7-hydroxy-4-oxo-4H-chromene-2-carboxylate · 3-(4-溴苯基)-7-羟基-4-氧代-4H-色烯-2-甲酸乙酯
Category: organic chemicals
The CAS registry number of ethyl 3-(4-bromophenyl)-7-hydroxy-4-oxo-4H-chromene-2-carboxylate is 96644-14-3.
Molecular formula C18H13BrO5, molecular weight 389.2.
It is also registered under: ethyl 3-(4-bromophenyl)-7-hydroxy-4-oxo-4H-chromene-2-carboxylate, 3-(4-溴苯基)-7-羟基-4-氧代-4H-色烯-2-甲酸乙酯.
Category: Organic Chemicals.
Independent reference data for ethyl 3-(4-bromophenyl)-7-hydroxy-4-oxo-4H-chromene-2-carboxylate (CAS 96644-14-3), compiled from public chemistry databases.
| CAS 号 | 96644-14-3 |
|---|---|
| PubChem CID | 5904528 |
| 分子式 | C18H13BrO5 |
| IUPAC 名称 | ethyl 3-(4-bromophenyl)-7-hydroxy-4-oxochromene-2-carboxylate |
| UNII（FDA） | ST50039237 |
| Molecular Weight | 389.2 |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 387.99464 |
| Monoisotopic Mass | 387.99464 |
| Topological Polar Surface Area | 72.8 |
| Heavy Atom Count | 24 |
96644-14-3; ethyl 3-(4-bromophenyl)-7-hydroxy-4-oxo-4H-chromene-2-carboxylate; ethyl 3-(4-bromophenyl)-7-hydroxy-4-oxochromene-2-carboxylate; SBB042197; STK888289; AKOS000270944; NCGC00287080-01; ST50039237; 4'-bromo-2-ethoxycarbonyl-7-hydroxyisoflavone; AB01286059-01; F1190-0482
3-(4-溴苯基)-7-羟基-4-氧代-4H-色烯-2-甲酸乙酯 · CAS 96644-14-3 · C18H13BrO5. UNII ST50039237.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.