RefChem:1084580
benzyl-[2-oxo-2-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)ethyl]-propan-2-ylazanium chloride
Also Known As: RefChem:1084580|AC1L21IV|Ethanone, 2-((1-methylethyl)(phenylmethyl)amino)-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-, hydrochloride|BENZYL-[2-OXO-2-(6,7,8,9-TETRAHYDRO-5H-BENZO[7]ANNULEN-2-YL)ETHYL]-PROPAN-2-YLAZANIUM CHLORIDE|ETHANONE, 2-((1-METHYLETHYL)(PHENYLMETHYL)AMINO)-1-(6,7,8,9-TETRAHYDRO-5H-BENZOC|benzyl-[2-oxo-2-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)ethyl]-propan-2-ylazanium chloride
| Molecular Formula | C23H30ClNO |
|---|---|
| Molecular Weight | 371.2016 g/mol |
| LogP | 0.64 |
| Topological Polar Surface Area | 21.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 371.2016 |
| Heavy Atoms | 26 |
| Complexity | 711.4 |
Chemical Identifiers
| CAS Number | 42882-45-1 |
|---|---|
| SMILES | CC(C)[NH+](CC1=CC=CC=C1)CC(=O)C2=CC3=C(CCCCC3)C=C2.[Cl-] |
Product Overview
RefChem:1084580 (CAS 42882-45-1), with molecular formula C23H30ClNO and molecular weight 371.2016 g/mol. IUPAC: benzyl-[2-oxo-2-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)ethyl]-propan-2-ylazanium chloride.
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