Desmethyldoxepin
3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N-methylpropan-1-amine
| Molecular Formula | C18H19NO |
|---|---|
| Molecular Weight | 265.3 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 21.3 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.14667 |
| Heavy Atoms | 20 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 1225-56-5 |
|---|---|
| SMILES | CNCCC=C1C2=CC=CC=C2COC3=CC=CC=C31 |
| InChIKey | HVKCEFHNSNZIHO-UHFFFAOYSA-N |
📖 Product Overview
Desmethyldoxepin (CAS: 1225-56-5) is a chemical compound with molecular formula C18H19NO and molecular weight 265.3 g/mol. Its IUPAC systematic name is 3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N-methylpropan-1-amine.
HVKCEFHNSNZIHO-UHFFFAOYSA-N.
SMILES: CNCCC=C1C2=CC=CC=C2COC3=CC=CC=C31.
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