Cas no 23057-98-9 (Dimethyl Fumarate-d2)

Dimethyl Fumarate-d2 structure
Dimethyl Fumarate-d2 structure
Product Name:Dimethyl Fumarate-d2
CAS No:23057-98-9
MF:C6H8O4
MW:146.137645721436
CID:251678
PubChem ID:12201064
Update Time:2025-04-19

Dimethyl Fumarate-d2 Chemical and Physical Properties

Names and Identifiers

    • 2-Butenedioic-2,3-d2acid, 1,4-dimethyl ester, (2E)-
    • 2,3-2H-fumaric acid
    • 2,3-dideuterio-fumaric acid
    • 2,3-dideuterio-fumaric acid dimethyl ester
    • 2,3-Dideuterio-fumarsaeure
    • 2,3-Dideuterio-fumarsaeure-dimethylester
    • 486671_ALDRICH
    • dimethyl [2H2]fumarate
    • dimethyl fumarate-d2
    • Fumaric acid-2,3-d2
    • I04-8843
    • Maleic acid-2,3-d2
    • Dimethyl fumarate-2,3-d2
    • D99134
    • Dimethyl fumarate-2,3-d2, 98 atom % D, 97% (CP)
    • CS-0623892
    • MFCD08704934
    • 23057-98-9
    • 1,4-dimethyl (2E)-(?H?)but-2-enedioate
    • dimethyl (E)-2, 3-dideuteriobut-2-enedioate
    • HY-17363S1
    • dimethyl (E)-2,3-dideuteriobut-2-enedioate
    • DB-319203
    • Fumaric-d2 Acid Dimethyl Ester; Dimethyl Fumarate-d2; (2E)-2-Butenedioic-2,3-d2 Acid Dimethyl Ester; (E)-2-Butenedioic-2,3-d2 Acid Dimethyl Ester
    • Dimethyl Fumarate-d2
    • Inchi: 1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3+/i3D,4D
    • InChI Key: LDCRTTXIJACKKU-SWIHUIHJSA-N
    • SMILES: O(C)C(/C(/[2H])=C(\[2H])/C(=O)OC)=O

Computed Properties

  • Exact Mass: 146.055
  • Monoisotopic Mass: 146.055
  • Isotope Atom Count: 2
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 4
  • Complexity: 141
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.7
  • Topological Polar Surface Area: 52.6A^2

Experimental Properties

  • Melting Point: 102-106 °C(lit.)
  • Boiling Point: 192-193 °C(lit.)
  • PSA: 52.60000
  • LogP: -0.11140

Dimethyl Fumarate-d2 Security Information

Dimethyl Fumarate-d2 Pricemore >>

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