ethyl 1-azabicyclo[2.2.2]octane-3-carboxylate (CAS 6238-33-1) — formula C17H11N3O4S, molecular weight 353.4; category organic chemicals.
| CAS Number | 6238-33-1 |
|---|---|
| Molecular Formula | C17H11N3O4S |
| Molecular Weight | 353.4 |
| LogP | 3.2 |
| Category | Organic Chemicals |
ethyl 1-azabicyclo[2.2.2]octane-3-carboxylate is a carbon-based organic compound with CAS registry number 6238-33-1 and molecular formula C17H11N3O4S (molecular weight 353.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 6238-33-1
Its molecular formula C17H11N3O4S comprises 17 C, 11 H, 3 N, 4 O, 1 S atoms.
Also known as: ethyl 1-azabicyclo[2.2.2]octane-3-carboxylate · 1-氮杂双环[2.2.2]辛烷-3-甲酸乙酯
Category: organic chemicals
The CAS registry number of ethyl 1-azabicyclo[2.2.2]octane-3-carboxylate is 6238-33-1.
Molecular formula C17H11N3O4S, molecular weight 353.4.
It is also registered under: ethyl 1-azabicyclo[2.2.2]octane-3-carboxylate, 1-氮杂双环[2.2.2]辛烷-3-甲酸乙酯.
Category: Organic Chemicals.
Independent reference data for ethyl 1-azabicyclo[2.2.2]octane-3-carboxylate (CAS 6238-33-1), compiled from public chemistry databases.
| CAS Registry Number | 6238-33-1 |
|---|---|
| PubChem CID | 1902042 |
| Molecular formula | C17H11N3O4S |
| IUPAC name | [2-[(5E)-5-(furan-2-ylmethylidene)-6-oxo-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl] acetate |
| UNII (FDA) | ST50032865 |
| Molecular Weight | 353.4 |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 353.04702701 |
| Monoisotopic Mass | 353.04702701 |
| Topological Polar Surface Area | 113 |
| Heavy Atom Count | 25 |
AC1LYL1K; DTXSID00365540; RefChem:313974; DTXCID30316580; 6238-33-1; 2-[(5E)-5-(2-furylmethylene)-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl acetate; 372500-54-4; SMSF0018450; STK808355; AKOS001665602; CB04425; BIM-0002583.P001; ST50032865; SR-01000492709; SR-01000492709-1; 2-[5-(2-furylmethylene)-6-oxo-1,3-thiazolidino[3,2-d]1,2,4-triazol-2-yl]phenyl acetate
ethyl 1-azabicyclo[2.2.2]octane-3-carboxylate · CAS 6238-33-1 · C17H11N3O4S. UNII ST50032865.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1-氮杂双环[2.2.2]辛烷-3-甲酸乙酯