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| IUPAC Name: | 3-(4-hydroxyphenyl)propanoic acid |
| Description: | Phloretic acid is a pheno isolated from boswellia carterii birdw. And it may have antifungal activity. |
| Molecular Weight: | 166.2 |
| Molecular Formula: | C9H10O3 |
| Canonical SMILES: | C1=CC(=CC=C1CCC(=O)O)O |
| InChI: | InChI=1S/C9H10O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5,10H,3,6H2,(H,11,12) |
| InChI Key: | NMHMNPHRMNGLLB-UHFFFAOYSA-N |
| Boiling Point: | 352.4 °C at 760 mmHg |
| Melting Point: | 129-131 °C(lit.) |
| Flash Point: | 181.1±17.4 °C |
| Purity: | 98 % |
| Density: | 1.26 g/cm3 |
| Solubility: | In Vitro: DMSO : 100 mg/mL(601.76 mM;Need ultrasonic) H2O : 33.33 mg/mL(200.57 mM;Need ultrasonic) In Vivo: 1.Add each solvent one by one:PBS Solubility: 100 mg/mL (601.76 mM); Clear solution; Need ultrasonic 2.Add each solvent one by one:10% DMSO >> 40%PEG300 >> 5%Tween-80 >> 45% saline Solubility: ≥ 2.5 mg/mL (15.04 mM); Clear solution 3.Add each solvent one by one:10% DMSO >> 90% (20%SBE-β-CDin saline) Solubility: ≥ 2.5 mg/mL (15.04 mM); Clear solution 4.Add each solvent one by one:10% DMSO >> 90%corn oil Solubility: ≥ 2.5 mg/mL (15.04 mM); Clear solution |
| Appearance: | Powder |
| Storage: | Powder: -20°C: 3 years 4°C: 2 years In solvent: -80°C: 6 months -20°C: 1 month |
| MDL: | MFCD00002778 |
| LogP: | 1.40940 |
| Vapor Pressure: | 0.0±0.8 mmHg at 25°C |
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(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
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