Physicochemical Properties
| Molecular Formula | C5H4CLN5 |
| Molecular Weight | 169.57 |
| Exact Mass | 169.015 |
| CAS # | 10310-21-1 |
| PubChem CID | 5360349 |
| Appearance | Off-white to light yellow solid powder |
| Density | 1.8±0.1 g/cm3 |
| Boiling Point | 315.2ºC at 760mmHg |
| Melting Point | >300 °C(lit.) |
| Flash Point | 144.4ºC |
| Vapour Pressure | 1.75E-15mmHg at 25°C |
| Index of Refraction | 1.827 |
| LogP | -0.03 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Heavy Atom Count | 11 |
| Complexity | 154 |
| Defined Atom Stereocenter Count | 0 |
| InChi Key | RYYIULNRIVUMTQ-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C5H4ClN5/c6-3-2-4(9-1-8-2)11-5(7)10-3/h1H,(H3,7,8,9,10,11) |
| Chemical Name | 6-chloro-7H-purin-2-amine |
| 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 Note: Please store this product in a sealed and protected environment (e.g. under nitrogen), avoid exposure to moisture and light. |
| 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
| ln Vitro | 2-Amino-6-chloropurine is a starting point for the creation of nucleotide analogs that have antiviral properties against the human herpesvirus 6 (HHV-6) and the Epstein-Barr virus (EBV). 11. (Z)- and (E)-2-((hydroxymethyl)cyclopropylidene)methyladenine and -guanine Qiu, Y.-L., Ksebati, MB, Ptak, RG, et al. New nucleotide analogs possessing wide-ranging antiviral efficacy 1998; J. Med. Chemistry 41(1): 10–23 |
| References |
[1]. (Z)- and (E)-2-((hydroxymethyl)cyclopropylidene)methyladenine and -guanine. New nucleotide analogues with a broad-spectrum antiviral activityJ. Med. Chem.41(1) 10-23 (1998). |
| Additional Infomation | 6-chloroguanine is an organochlorine compound that is 7H-purin-2-amine substituted by a chloro group at position 6. It is a member of 2-aminopurines and an organochlorine compound. |
Solubility Data
| Solubility (In Vitro) | DMSO: 33.33 mg/mL (196.56 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (14.74 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.  (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 5.8973 mL | 29.4863 mL | 58.9727 mL | |
| 5 mM | 1.1795 mL | 5.8973 mL | 11.7945 mL | |
| 10 mM | 0.5897 mL | 2.9486 mL | 5.8973 mL |