3,7-Diazabicyclo(3.3.1)nonane, 7-butyl-3-(3,4-dichlorobenzoyl)-, fumarate
(7-butyl-3-aza-7-azoniabicyclo[3.3.1]nonan-3-yl)-(3,4-dichlorophenyl)methanone;(Z)-4-hydroxy-4-oxobut-2-enoate
Also Known As: 7-Butyl-3-(3,4-dichlorobenzoyl)bispidine fumarate|3,7-DIAZABICYCLO(3.3.1)NONANE, 7-BUTYL-3-(3,4-DICHLOROBENZOYL)-, FUMARATE|7-Butyl-3-(3,4-dichlorobenzoyl)-3,7-diazabicyclo(3.3.1)nonane fumarate|(7-butyl-3-aza-7-azoniabicyclo[3.3.1]nonan-3-yl)-(3,4-dichlorophenyl)methanone; (Z)-4-hydroxy-4-oxobut-2-enoate|3,7-Diazabicyclo[3.3.1]nonane, 3-butyl-7-(3,4-dichlorobenzoyl)-, (E)-2-butenedioate (1:1)
| Molecular Formula | C22H28Cl2N2O5 |
|---|---|
| Molecular Weight | 470.1375 g/mol |
| LogP | 1.1474 |
| Topological Polar Surface Area | 102.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 470.1375 |
| Monoisotopic Mass | 470.1375 |
| Heavy Atoms | 31 |
| Complexity | 800.1193 |
Chemical Identifiers
| CAS Number | 70802-34-5 |
|---|---|
| SMILES | CCCC[NH+]1CC2CC(C1)CN(C2)C(=O)C3=CC(=C(C=C3)Cl)Cl.C(=C\C(=O)[O-])\C(=O)O |
Product Overview
3,7-Diazabicyclo(3.3.1)nonane, 7-butyl-3-(3,4-dichlorobenzoyl)-, fumarate (CAS 70802-34-5), with molecular formula C22H28Cl2N2O5 and molecular weight 470.1375 g/mol. IUPAC: (7-butyl-3-aza-7-azoniabicyclo[3.3.1]nonan-3-yl)-(3,4-dichlorophenyl)methanone;(Z)-4-hydroxy-4-oxobut-2-enoate.
3,7-Diazabicyclo(3.3.1)nonane, 7-butyl-3-(3,4-dichlorobenzoyl)-, fumarate is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »