SCHEMBL30496700
2-(1,3-benzodioxol-5-yl)-N-[2-(1,3-benzodioxol-5-yl)ethyl]ethanamine
| Molecular Formula | C18H19NO4 |
|---|---|
| Molecular Weight | 313.3 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 49.0 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.1314 |
| Heavy Atoms | 23 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 99004-00-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CCNCCC3=CC4=C(C=C3)OCO4 |
| InChIKey | YRROTAXHOMYTBA-UHFFFAOYSA-N |
📖 Product Overview
SCHEMBL30496700 (CAS: 99004-00-9) is a chemical compound with molecular formula C18H19NO4 and molecular weight 313.3 g/mol. Its IUPAC systematic name is 2-(1,3-benzodioxol-5-yl)-N-[2-(1,3-benzodioxol-5-yl)ethyl]ethanamine.
YRROTAXHOMYTBA-UHFFFAOYSA-N.
SMILES: C1OC2=C(O1)C=C(C=C2)CCNCCC3=CC4=C(C=C3)OCO4.
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