Ammonium, diethyl(2-hydroxyethyl)methyl-, bromide, 3-hydroxy-2-phenylbutyrate
diethyl-[2-(4-hydroxy-2-phenylbutanoyl)oxyethyl]-methylazanium bromide
Also Known As: ACMC-20mcc7|RefChem:319218|AC1L1T1T|AC1Q1RI7|CTK4A6554|JLPLYWKGNATVMB-UHFFFAOYSA-M|Diethyl(2-hydroxyethyl)methylammonium bromide 3-hydroxy-2-phenylbutyrate|AMMONIUM, DIETHYL(2-HYDROXYETHYL)METHYL-, BROMIDE, 3-HYDROXY-2-PHENYLBUTYRATE|diethyl-[2-(4-hydroxy-2-phenylbutanoyl)oxyethyl]-methylazanium;bromide|2-(3'-Chloro-4'-methoxy-[1,1'-biphenyl]-4-yl)-2-oxoacetaldehyde|DIETHYL-[2-(4-HYDROXY-2-PHENYL-BUTANOYL)OXYETHYL]-METHYL-AZANIUM BROMIDE|Ethanaminium,N,N-diethyl-2-(3-hydroxy-1-oxo-2-phenylbutoxy)-N-methyl-, bromide (1:1)|diethyl-[2-(4-hydroxy-2-phenylbutanoyl)oxyethyl]-methylazanium bromide|diethyl-[2-(4-hydroxy-2-phenylbutanoyl)oxyethyl]-methylazanium,bromide|N,N-Diethyl-2-[(4-hydroxy-2-phenylbutanoyl)oxy]-N-methylethan-1-aminium bromide|n,n-diethyl-2-[(4-hydroxy-2-phenylbutanoyl)oxy]-n-methylethanaminium bromide
| Molecular Formula | C17H28BrNO3 |
|---|---|
| Molecular Weight | 373.12527 g/mol |
| LogP | -0.81 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 373.12527 |
| Heavy Atoms | 22 |
| Complexity | 421.2 |
Chemical Identifiers
| CAS Number | 109513-52-2 |
|---|---|
| SMILES | CC[N+](C)(CC)CCOC(=O)C(CCO)C1=CC=CC=C1.[Br-] |
Product Overview
Ammonium, diethyl(2-hydroxyethyl)methyl-, bromide, 3-hydroxy-2-phenylbutyrate (CAS 109513-52-2), with molecular formula C17H28BrNO3 and molecular weight 373.12527 g/mol. IUPAC: diethyl-[2-(4-hydroxy-2-phenylbutanoyl)oxyethyl]-methylazanium bromide.
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