Cas no 14770-51-5 (Propanoic-2,2-d2 acid-d(9CI))

Propanoic-2,2-d2 acid-d (9CI) is a deuterated form of propionic acid, where hydrogen atoms at the 2-position and the acidic proton are replaced with deuterium. This isotopic labeling enhances its utility in NMR spectroscopy and kinetic studies, providing distinct spectral signatures and reduced signal overlap. The compound is particularly valuable in mechanistic research, metabolic studies, and as a tracer in chemical and biochemical applications. Its high isotopic purity ensures reliable data interpretation, while its stability under standard conditions makes it suitable for a range of experimental setups. This deuterated derivative is essential for researchers requiring precise isotopic labeling in organic and analytical chemistry.
Propanoic-2,2-d2 acid-d(9CI) structure
Propanoic-2,2-d2 acid-d(9CI) structure
Product Name:Propanoic-2,2-d2 acid-d(9CI)
CAS No:14770-51-5
MF:C3H6O2
MW:77.097026348114
CID:138188
PubChem ID:16212409
Update Time:2025-10-16

Propanoic-2,2-d2 acid-d(9CI) Chemical and Physical Properties

Names and Identifiers

    • Propanoic-2,2-d2 acid-d(9CI)
    • Propionic-2,2-D2 Acid-D
    • (2,2-2H2)propan(2H)oic acid
    • PROPIONIC-2,2-D2 ACID
    • PROPIONIC ACID (2,2-D2)
    • PROPIONIC-2,2-D2 ACID-D, 99 ATOM % D
    • deuterio 2,2-dideuteriopropanoate
    • (2,2-~2~H_2_)Propan(~2~H)oic acid
    • DTXSID20583628
    • PROPIONIC-2,2-D2ACID
    • J-008401
    • 14770-51-5
    • Inchi: 1S/C3H6O2/c1-2-3(4)5/h2H2,1H3,(H,4,5)/i2D2/hD
    • InChI Key: XBDQKXXYIPTUBI-VLZJNYFYSA-N
    • SMILES: O([2H])C(C([2H])([2H])C)=O

Computed Properties

  • Exact Mass: 80.0744
  • Monoisotopic Mass: 77.055609668g/mol
  • Isotope Atom Count: 3
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 5
  • Rotatable Bond Count: 1
  • Complexity: 40.2
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Color/Form: Not available
  • Density: 1.03?g/mL?at 25?°C(lit.)
  • Melting Point: ?24-?23?°C(lit.)
  • Boiling Point: 141?°C(lit.)
  • Flash Point: 125?°F
  • Refractive Index: n20/D 1.386(lit.)
  • PSA: 26.3
  • Solubility: Not available

Propanoic-2,2-d2 acid-d(9CI) Security Information

  • Hazardous Material transportation number:UN 3463 8/PG 2
  • WGK Germany:3
  • Hazard Category Code: 34
  • Safety Instruction: 23-36-45
  • Hazardous Material Identification: C

Propanoic-2,2-d2 acid-d(9CI) Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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