Physicochemical Properties
Molecular Formula | C5H4D5NO4 |
Molecular Weight | 152.16 |
Exact Mass | 152.084 |
CAS # | 2784-50-1 |
Related CAS # | L-Glutamic acid;56-86-0 |
PubChem CID | 12248503 |
Appearance | White to off-white solid powder |
Density | 1.4±0.1 g/cm3 |
Boiling Point | 333.8±32.0 °C at 760 mmHg |
Melting Point | 205ºC (dec.)(lit.) |
Flash Point | 155.7±25.1 °C |
Vapour Pressure | 0.0±1.5 mmHg at 25°C |
Index of Refraction | 1.522 |
LogP | -1.43 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Heavy Atom Count | 10 |
Complexity | 145 |
Defined Atom Stereocenter Count | 1 |
SMILES | [2H][C@@](C(=O)O)(C([2H])([2H])C([2H])([2H])C(=O)O)N |
InChi Key | WHUUTDBJXJRKMK-NKXUJHECSA-N |
InChi Code | InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1/i1D2,2D2,3D |
Chemical Name | (2S)-2-amino-2,3,3,4,4-pentadeuteriopentanedioic acid |
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
ln Vitro | Drug compounds have included stable heavy isotopes of carbon, hydrogen, and other elements, mostly as quantitative tracers while the drugs were being developed. Because deuteration may have an effect on a drug's pharmacokinetics and metabolic properties, it is a cause for concern [1]. |
References |
[1]. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-216. |
Additional Infomation | L-glutamic acid-d5 is a L-glutamic acid and a deuterated compound. |
Solubility Data
Solubility (In Vitro) | H2O : 14.29 mg/mL (93.91 mM) |
Solubility (In Vivo) |
Solubility in Formulation 1: 7.14 mg/mL (46.92 mM) in PBS (add these co-solvents sequentially from left to right, and one by one), clear solution; with sonication (<60°C).  (Please use freshly prepared in vivo formulations for optimal results.) |
Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
1 mM | 6.5720 mL | 32.8601 mL | 65.7203 mL | |
5 mM | 1.3144 mL | 6.5720 mL | 13.1441 mL | |
10 mM | 0.6572 mL | 3.2860 mL | 6.5720 mL |