5H-Pyrazolo[4,3-d][1,3]oxazepin-5-one,1,4,7,8-tetrahydro-3,7,7-trimethyl- (CAS 72499-52-6) — formula C9H13N3O2, molecular weight 195.22; category organic chemicals.
| CAS Number | 72499-52-6 |
|---|---|
| Molecular Formula | C9H13N3O2 |
| Molecular Weight | 195.22 |
| LogP | 0.9 |
| Category | Organic Chemicals |
5H-Pyrazolo[4,3-d][1,3]oxazepin-5-one,1,4,7,8-tetrahydro-3,7,7-trimethyl- is a carbon-based organic compound with CAS registry number 72499-52-6 and molecular formula C9H13N3O2 (molecular weight 195.22), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72499-52-6
Its molecular formula C9H13N3O2 comprises 9 C, 13 H, 3 N, 2 O atoms.
Also known as: 5H-Pyrazolo[4,3-d][1,3]oxazepin-5-one,1,4,7,8-tetrahydro-3,7,7-trimethyl- · 5H-吡唑并[4,3-d][1,3]恶氮平-5-酮,1,4,7,8-四氢-3,7,7-三甲基-
Category: organic chemicals
The CAS registry number of 5H-Pyrazolo[4,3-d][1,3]oxazepin-5-one,1,4,7,8-tetrahydro-3,7,7-trimethyl- is 72499-52-6.
Molecular formula C9H13N3O2, molecular weight 195.22.
It is also registered under: 5H-Pyrazolo[4,3-d][1,3]oxazepin-5-one,1,4,7,8-tetrahydro-3,7,7-trimethyl-, 5H-吡唑并[4,3-d][1,3]恶氮平-5-酮,1,4,7,8-四氢-3,7,7-三甲基-.
Category: Organic Chemicals.
Independent reference data for 5H-Pyrazolo[4,3-d][1,3]oxazepin-5-one,1,4,7,8-tetrahydro-3,7,7-trimethyl- (CAS 72499-52-6), compiled from public chemistry databases.
| CAS 号 | 72499-52-6 |
|---|---|
| PubChem CID | 335532 |
| 分子式 | C9H13N3O2 |
| IUPAC 名称 | 3,7,7-trimethyl-4,8-dihydro-2H-pyrazolo[4,3-d][1,3]oxazepin-5-one |
| UNII（FDA） | 03U2IMZ99K |
| Molecular Weight | 195.22 |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 195.100776666 |
| Monoisotopic Mass | 195.100776666 |
| Topological Polar Surface Area | 67 |
| Heavy Atom Count | 14 |
72499-52-6; 03U2IMZ99K; UNII-03U2IMZ99K; 3,7,7-Trimethyl-1,4,7,8-tetrahydro-5H-pyrazolo(4,3-d)(1,3)oxazepin-5-one; NSC 345654; NSC-345654; DTXSID90222794; 5H-PYRAZOLO(4,3-D)(1,3)OXAZEPIN-5-ONE, 1,4,7,8-TETRAHYDRO-3,7,7-TRIMETHYL-; 3,7,7-Trimethyl-1,4,7,8-tetrahydro-5H-pyrazolo[4,3-d][1,3]oxazepin-5-one; RefChem:91825; DTXCID20145285; NSC345654; 3,7,7-Trimethyl-2,4,7,8-tetrahydro-5H-pyrazolo[4,3-d][1,3]oxazepin-5-one; 3,7,7-trimethyl-4,8-dihydro-1H-pyrazolo[4,3-d][1,3]oxazepin-5-one
5H-吡唑并[4,3-d][1,3]恶氮平-5-酮,1,4,7,8-四氢-3,7,7-三甲基- · CAS 72499-52-6 · C9H13N3O2. UNII 03U2IMZ99K.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.