Physicochemical Properties
| Molecular Formula | C4H9N3O2.H2O |
| Molecular Weight | 149.14844 |
| Exact Mass | 152.098 |
| CAS # | 284664-86-4 |
| Related CAS # | Creatine;57-00-1 |
| PubChem CID | 16213871 |
| Appearance | White to off-white solid powder |
| Melting Point | 292ºC (dec.)(lit.) |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Heavy Atom Count | 10 |
| Complexity | 134 |
| Defined Atom Stereocenter Count | 0 |
| SMILES | [2H]C([2H])([2H])N(CC(=O)O)C(=N)N.O |
| InChi Key | MEJYXFHCRXAUIL-NIIDSAIPSA-N |
| InChi Code | InChI=1S/C4H9N3O2.H2O/c1-7(4(5)6)2-3(8)9;/h2H2,1H3,(H3,5,6)(H,8,9);1H2/i1D3; |
| Chemical Name | 2-[carbamimidoyl(trideuteriomethyl)amino]acetic acid;hydrate |
| 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
| References |
[1]. Beyond sports: Efficacy and safety of creatine supplementation in pathological or paraphysiological conditions of brain and muscle. Med Res Rev. 2019;39(6):2427-2459. |
Solubility Data
| Solubility (In Vitro) | H2O : ~25 mg/mL (~164.29 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: 6.67 mg/mL (43.83 mM) in PBS (add these co-solvents sequentially from left to right, and one by one), clear solution; with sonication.  (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 6.7047 mL | 33.5233 mL | 67.0466 mL | |
| 5 mM | 1.3409 mL | 6.7047 mL | 13.4093 mL | |
| 10 mM | 0.6705 mL | 3.3523 mL | 6.7047 mL |