Phenol, 3-(1-methyl-3-neopentyl-3-pyrrolidinyl)-, citrate
3-[3-(2,2-dimethylpropyl)-1-methylpyrrolidin-3-yl]phenol;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: 3-(1-Methyl-3-neopentyl-3-pyrrolidinyl)phenol citrate|Phenol, 3-(1-methyl-3-neopentyl-3-pyrrolidinyl)-, citrate|Pyrrolidine, 3-(m-hydroxyphenyl)-1-methyl-3-neopentyl-, citrate|3-[3-(2,2-Dimethylpropyl)-1-methyl-3-pyrrolidinyl]phenol 2-h|3-[3-(2,2-dimethylpropyl)-1-methylpyrrolidin-3-yl]phenol 2-hydroxypropane-1,2,3-tricarboxylate(1:1)|2-Hydroxypropane-1,2,3-tricarboxylic acid--3-[3-(2,2-dimethylpropyl)-1-methylpyrrolidin-3-yl]phenol (1/1)|3-[3-(2,2-dimethylpropyl)-1-methylpyrrolidin-3-yl]phenol; 2-hydroxypropane-1,2,3-tricarboxylic acid
| Molecular Formula | C22H33NO8 |
|---|---|
| Molecular Weight | 439.2206 g/mol |
| LogP | 2.15 |
| Topological Polar Surface Area | 155.6 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 439.2206 |
| Heavy Atoms | 31 |
| Complexity | 784.9 |
Chemical Identifiers
| CAS Number | 64047-76-3 |
|---|---|
| SMILES | CC(C)(C)CC1(CCN(C1)C)C2=CC(=CC=C2)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
Product Overview
Phenol, 3-(1-methyl-3-neopentyl-3-pyrrolidinyl)-, citrate (CAS 64047-76-3), with molecular formula C22H33NO8 and molecular weight 439.2206 g/mol. IUPAC: 3-[3-(2,2-dimethylpropyl)-1-methylpyrrolidin-3-yl]phenol;2-hydroxypropane-1,2,3-tricarboxylic acid.
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