3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid ter-butyl ester (CAS 98626-45-0) — formula C16H22N2O3, molecular weight 290.36; category organic chemicals.
| CAS Number | 98626-45-0 |
|---|---|
| Molecular Formula | C16H22N2O3 |
| Molecular Weight | 290.36 |
| LogP | 1.7 |
| Category | Organic Chemicals |
3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid ter-butyl ester is a carbon-based organic compound with CAS registry number 98626-45-0 and molecular formula C16H22N2O3 (molecular weight 290.36), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 98626-45-0
Its molecular formula C16H22N2O3 comprises 16 C, 22 H, 2 N, 3 O atoms.
Also known as: 3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid ter-butyl ester · 2-(3-氨基-2-氧代-2,3,4,5-四氢-1H-苯并[b]吖庚因-1-基)乙酸叔丁酯
Category: organic chemicals
The CAS registry number of 3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid ter-butyl ester is 98626-45-0.
Molecular formula C16H22N2O3, molecular weight 290.36.
It is also registered under: 3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid ter-butyl ester, 2-(3-氨基-2-氧代-2,3,4,5-四氢-1H-苯并[b]吖庚因-1-基)乙酸叔丁酯.
Category: Organic Chemicals.
Independent reference data for 3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid ter-butyl ester (CAS 98626-45-0), compiled from public chemistry databases.
| CAS 号 | 98626-45-0 |
|---|---|
| PubChem CID | 3674165 |
| 分子式 | C16H22N2O3 |
| IUPAC 名称 | tert-butyl 2-(3-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetate |
| UNII（FDA） | NS00001963 |
| Molecular Weight | 290.36 |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 290.16304257 |
| Monoisotopic Mass | 290.16304257 |
| Topological Polar Surface Area | 72.6 |
| Heavy Atom Count | 21 |
98626-45-0; tert-butyl 2-(3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)acetate; 3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-1-t-butyl acetate; tert-butyl 2-(3-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetate; 3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid ter-butyl ester; 3-AMINO-2,3,4,5-TETRAHYDRO-2-OXO-1H-1-BENZAZEPINE-1-ACETIC ACID TERT-BUTYL ESTER; MFCD02258988; CHEMBL295683; tert-butyl 2-(3-amino-2-oxo-2,3,4,5-tetrahydrobenzo[b]azepin-1-yl)acetate; tert-butyl 3-amino-2,3,4,5-tetrahydro-2-oxo-1h-1-benzazepine-1-acetate; SCHEMBL5672901; T-butyl,3S-amino-2,3,4,5-tetrahydro-1H-[1]benaepin-2-one-1acetate; DTXSID70394908; QTEDVVHLTMELTB-UHFFFAOYSA-N; tert-butyl (3-amino-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)acetate; 1H-1-Benzazepine-1-acetic acid, 3-amino-2,3,4,5-tetrahydro-2-oxo-, 1,1-dimethylethyl ester, (R)- (9CI)
2-(3-氨基-2-氧代-2,3,4,5-四氢-1H-苯并[b]吖庚因-1-基)乙酸叔丁酯 · CAS 98626-45-0 · C16H22N2O3. UNII NS00001963.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.