BK 66
2-hydroxy-2-oxoacetate;3-pyrrolidin-1-ium-1-ylpropyl N-(2-heptoxyphenyl)carbamate
Also Known As: RefChem:329989|BK 66|BK-66|AC1L18S2|3-(1-Pyrrolidinyl)propyl o-(heptyloxy)carbanilate oxalate (1:1)|Carbamic acid, (2-(heptyloxy)phenyl)-, 3-(1-pyrrolidinyl)propyl ester, ethanedioate (1:1)|CARBANILIC ACID, o-(HEPTYLOXY)-, 3-(1-PYRROLIDINYL)PROPYL ESTER, OXALATE (1:1)|o-(Heptyloxy)carbanilic acid 3-(1-pyrrolidinyl)propyl ester oxalate (1:1)|1-[3-({[2-(Heptyloxy)phenyl]carbamoyl}oxy)propyl]pyrrolidin-1-ium hydrogen ethanedioate|2-hydroxy-2-oxoacetate; 3-pyrrolidin-1-ium-1-ylpropyl N-(2-heptoxyphenyl)carbamate
| Molecular Formula | C23H36N2O7 |
|---|---|
| Molecular Weight | 452.25226 g/mol |
| LogP | 1.47 |
| Topological Polar Surface Area | 129.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 452.25226 |
| Heavy Atoms | 32 |
| Complexity | 678.7 |
Chemical Identifiers
| CAS Number | 68931-07-7 |
|---|---|
| SMILES | CCCCCCCOC1=CC=CC=C1NC(=O)OCCC[NH+]2CCCC2.C(=O)(C(=O)[O-])O |
Product Overview
BK 66 (CAS 68931-07-7), with molecular formula C23H36N2O7 and molecular weight 452.25226 g/mol. IUPAC: 2-hydroxy-2-oxoacetate;3-pyrrolidin-1-ium-1-ylpropyl N-(2-heptoxyphenyl)carbamate.
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