2-(Methylamino)-1-phenyl-1-propanol; (1S,2S)-form, Sulfate
AlkaPlorer ID: AK305878
Synonym: Pseudoephedrine sulfate, D-Isoephedrine sulfate, Afrinol
IUPAC Name: 2-(methylamino)-1-phenylpropan-1-ol
Structure
SMILES: CNC(C)C(O)C1=CC=CC=C1
InChI: InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3
InChIKey: KWGRBVOPPLSCSI-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Ephedra | Ephedraceae | Ephedrales | Gnetopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | None | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Sida cordifolia | Sida | Malvaceae | Malvales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Ephedra | Ephedraceae | Ephedrales | Gnetopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 165.236
TPSA？: 32.26
MolLogP？: 1.3279
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| None | No relevant target | pKa | 9.73 | None | 10.1007/s11095-013-1232-z |
| None | Unchecked | pKb | 5.04 | None | 10.1021/jm00207a015 |