NSC38171
2-chloro-N-[(4,4-dimethyl-11-phenyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecan-9-yl)methyl]-N-ethylethanamine
Also Known As: 2-Chloro-N-[(2,2-dimethyl-5-phenyltetrahydro-2H,3bH,5H-[1,3]dioxolo[4,5]furo[3,2-d][1,3]dioxin-7-yl)methyl]-N-ethylethan-1-amine|2-chloro-N-[(4,4-dimethyl-11-phenyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecan-9-yl)methyl]-N-ethylethanamine
CAS: 6339-02-2
| Molecular Formula | C20H28ClNO5 |
|---|---|
| Molecular Weight | 397.1656 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 397.1656 |
| Monoisotopic Mass | 397.1656 |
| Heavy Atoms | 27 |
| Complexity | 501.0 |
Chemical Identifiers
| CAS Number | 6339-02-2 |
|---|---|
| SMILES | CCN(CCCl)CC1C2C(C3C(O2)OC(O3)(C)C)OC(O1)C4=CC=CC=C4 |
| InChIKey | FYMKEJXMZYODON-UHFFFAOYSA-N |
Product Overview
NSC38171 (CAS 6339-02-2), with molecular formula C20H28ClNO5 and molecular weight 397.1656 g/mol. IUPAC: 2-chloro-N-[(4,4-dimethyl-11-phenyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecan-9-yl)methyl]-N-ethylethanamine.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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