3-[(11E)-Dibenzo[b,e]oxepin-11(6H)-ylidene]-N,N-dimethyl-1-propaneamine (CAS 3607-34-9) — formula C19H21NO, molecular weight 279.4; category organic chemicals.
| CAS Number | 3607-34-9 |
|---|---|
| Molecular Formula | C19H21NO |
| Molecular Weight | 279.4 |
| LogP | 4.3 |
| Applications | Pharmaceuticals |
| Category | Organic Chemicals |
Documented applications: Pharmaceuticals.
3-[(11E)-Dibenzo[b,e]oxepin-11(6H)-ylidene]-N,N-dimethyl-1-propaneamine is a carbon-based organic compound with CAS registry number 3607-34-9 and molecular formula C19H21NO (molecular weight 279.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3607-34-9
Its molecular formula C19H21NO comprises 19 C, 21 H, 1 N, 1 O atoms.
Also known as: 3-[(11E)-Dibenzo[b,e]oxepin-11(6H)-ylidene]-N,N-dimethyl-1-propaneamine · (E)-D氧杂环庚烷
Category: organic chemicals
The CAS registry number of 3-[(11E)-Dibenzo[b,e]oxepin-11(6H)-ylidene]-N,N-dimethyl-1-propaneamine is 3607-34-9.
Molecular formula C19H21NO, molecular weight 279.4.
It is also registered under: 3-[(11E)-Dibenzo[b,e]oxepin-11(6H)-ylidene]-N,N-dimethyl-1-propaneamine, (E)-D氧杂环庚烷.
Recorded applications: Pharmaceuticals.
Category: Organic Chemicals.
Independent reference data for 3-[(11E)-Dibenzo[b,e]oxepin-11(6H)-ylidene]-N,N-dimethyl-1-propaneamine (CAS 3607-34-9), compiled from public chemistry databases.
| CAS 号 | 3607-34-9 |
|---|---|
| PubChem CID | 667477 |
| 分子式 | C19H21NO |
| IUPAC 名称 | (3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine |
| UNII（FDA） | 851NLB57HQ |
| Molecular Weight | 279.4 |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 279.162314293 |
| Monoisotopic Mass | 279.162314293 |
| Topological Polar Surface Area | 12.5 |
| Heavy Atom Count | 21 |
| Dissociation Constants | 8.7 |
|---|
(e)-doxepin; trans-doxepin; Doxepin, (E)-; Doxepinum [INN-Latin]; Doxepina [INN-Spanish]; Sinequan; 3607-34-9; Sinequan (TN); (3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine; 851NLB57HQ; Doxepin [USAN]; Doxepine hydrochloride; 11-(3-Dimethylaminopropylidene)-6,11-dihydrodibenz(b,e)oxipin; MF 10; (3e)-3-(Dibenzo[b,E]oxepin-11(6h)-Ylidene)-N,N-Dimethylpropan-1-Amine; Doxepin (INN)
| 已通报的危害声明 | H301 (100%), H361 (100%), H362 (100%), H410 (100%) |
|---|
(E)-D氧杂环庚烷 · CAS 3607-34-9 · C19H21NO. UNII 851NLB57HQ. Dissociation Constants: 8.7.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: (E)-D氧杂环庚烷