Pentanoic-d9 acid

• CAS: 115871-50-6
• Catalog Number: ACM115871506
• Category: Other Products
• Molecular Weight: 111.19
• Molecular Formula: C₅HD₉O₂
• Synonyms: Valeric acid-D9
• IUPAC Name: 2,2,3,3,4,4,5,5,5-nonadeuteriopentanoic acid
• Canonical SMILES: CCCCC(=O)O
• InChI: InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)/i1D3,2D2,3D2,4D2
• InChI Key: NQPDZGIKBAWPEJ-YNSOAAEFSA-N
• Boiling Point: 185 °C (lit.)
• Melting Point: -20-18 °C (lit.)
• Flash Point: 192 °F
• Density: 1.022 g/mL at 25 °C
• Chemical Formula: CD3(CD2)3COOH
• Exact Mass: 111.12500
• Hazard Statements: C: Corrosive
• H-Bond Acceptor: 2
• H-Bond Donor: 1
• Isomeric SMILES: [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)O
• Safety Description: 26-36-45-61
• Stability: Stable if stored under recommended conditions. After three years, the compound should be re-analyzed for chemical purity before use.
• Storage Conditions: Store at room temperature