Physicochemical Properties
| Molecular Formula | C6H13CL2N3O |
| Molecular Weight | 214.09 |
| Exact Mass | 213.043 |
| CAS # | 1596-64-1 |
| PubChem CID | 197743 |
| Appearance | White to off-white solid powder |
| Boiling Point | 455.5ºC |
| Melting Point | 198-201 °C (dec.)(lit.) |
| Flash Point | 229.3ºC |
| Vapour Pressure | 4.34E-09mmHg at 25°C |
| LogP | 1.576 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Heavy Atom Count | 12 |
| Complexity | 99 |
| Defined Atom Stereocenter Count | 1 |
| SMILES | C1=C(NC=N1)C[C@@H](CO)N.Cl.Cl |
| InChi Key | FRCAFNBBXRWXQA-XRIGFGBMSA-N |
| InChi Code | InChI=1S/C6H11N3O.2ClH/c7-5(3-10)1-6-2-8-4-9-6;;/h2,4-5,10H,1,3,7H2,(H,8,9);2*1H/t5-;;/m0../s1 |
| Chemical Name | (2S)-2-amino-3-(1H-imidazol-5-yl)propan-1-ol;dihydrochloride |
| HS Tariff Code | 2934.99.9001 |
| Storage |
Powder-20°C 3 years 4°C 2 years In solvent -80°C 6 months -20°C 1 month |
| Shipping Condition | Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs) |
Biological Activity
| Additional Infomation | L-Histidinol dihydrochloride is an aralkylamine. |
Solubility Data
| Solubility (In Vitro) |
H2O: 100 mg/mL (467.09 mM) DMSO: 100 mg/mL (467.09 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (11.68 mM) (saturation unknown) in 10% DMSO + 40% PEG300 + 5% Tween80 + 45% Saline (add these co-solvents sequentially from left to right, and one by one), clear solution. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 400 μL PEG300 and mix evenly; then add 50 μL Tween-80 to the above solution and mix evenly; then add 450 μL normal saline to adjust the volume to 1 mL. Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH₂ O to obtain a clear solution. Solubility in Formulation 2: ≥ 2.5 mg/mL (11.68 mM) (saturation unknown) in 10% DMSO + 90% (20% SBE-β-CD in Saline) (add these co-solvents sequentially from left to right, and one by one), clear solution. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of 20% SBE-β-CD physiological saline solution and mix evenly. Preparation of 20% SBE-β-CD in Saline (4°C,1 week): Dissolve 2 g SBE-β-CD in 10 mL saline to obtain a clear solution. Solubility in Formulation 3: ≥ 2.5 mg/mL (11.68 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly. Solubility in Formulation 4: 100 mg/mL (467.09 mM) in PBS (add these co-solvents sequentially from left to right, and one by one), clear solution; with ultrasonication.  (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 4.6709 mL | 23.3547 mL | 46.7093 mL | |
| 5 mM | 0.9342 mL | 4.6709 mL | 9.3419 mL | |
| 10 mM | 0.4671 mL | 2.3355 mL | 4.6709 mL |