Valproic acid (Propyl-1,1-D2, pentanoic-3,3-D2)
Catalog Number |
ACM87745173-1 |
CAS |
87745-17-3 |
Structure |
|
Synonyms |
2-pentanoic-d2 acid |
IUPAC Name |
3,3-dideuterio-2-(1,1-dideuteriopropyl)pentanoic acid |
Molecular Weight |
148.24 |
Molecular Formula |
C8H12D4O2 |
InChI |
InChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)/i5D2,6D2 |
InChI Key |
NIJJYAXOARWZEE-NZLXMSDQSA-N |
Boiling Point |
220 °C (428 °F) |
Flash Point |
111 °C (232 °F)-closed cup |
Purity |
98% |
Density |
0.9 g/mL at 25 °C (77 °F) |
Solubility |
Water: 2 g/L-slightly soluble |
Appearance |
Colourless liquid |
Chemical Formula |
(CH3CH2CD2)2CHCO2H |
Isomeric SMILES |
[2H]C([2H])(CC)C(C(=O)O)C([2H])([2H])CC |
Isotopic Enrichment |
98 atom % D |
Stability |
Stable if stored under recommended conditions. |
Unlabeled CAS |
99-66-1 |
Unlabeled Synonyms |
2-Propylpentanoic acid |
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