Cas no 308796-47-6 (2-Propenoic-2,3-d2acid, 3-(phenyl-d5)- (9CI))

2-Propenoic-2,3-d2acid, 3-(phenyl-d5)- (9CI) structure
308796-47-6 structure
Product Name:2-Propenoic-2,3-d2acid, 3-(phenyl-d5)- (9CI)
CAS No:308796-47-6
MF:C9H8O2
MW:155.201754570007
CID:304566
PubChem ID:16213746
Update Time:2025-04-19

2-Propenoic-2,3-d2acid, 3-(phenyl-d5)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 2-Propenoic-2,3-d2acid, 3-(phenyl-d5)- (9CI)
    • J-018189
    • SCHEMBL18229947
    • CS-0590593
    • DTXSID50584103
    • trans-cinnamic acid-d7
    • HY-N0610S1
    • D98870
    • 343338-31-8
    • (E)-2,3-dideuterio-3-(2,3,4,5,6-pentadeuteriophenyl)prop-2-enoic acid
    • trans-Cinnamic-d7 acid, 98 atom % D
    • (2E)-3-(~2~H_5_)Phenyl(~2~H_2_)prop-2-enoic acid
    • 3-Phenyl-d5-2-propenoic acid-2,3-d2
    • trans-Cinnamic-d7 acid
    • 308796-47-6
    • (2E)-3-(Phenyl-2,3,4,5,6-d5)-2-propenoic-2,3-d2 Acid
    • DA-59479
    • 2-Propenoic-2,3-d2 acid, 3-(phenyl-2,3,4,5,6-d5)-, (2E)- (ACI); (2E)-3-(Phenyl-2,3,4,5,6-d5)-2-propenoic-2,3-d2 acid (ACI); 2-Propenoic-2,3-d2 acid, 3-(phenyl-d5)-, (2E)- (9CI); trans-Cinnamic-d7 acid; trans-Cinnamic acid D7
    • Inchi: 1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+/i1D,2D,3D,4D,5D,6D,7D
    • InChI Key: WBYWAXJHAXSJNI-UJMUNGNDSA-N
    • SMILES: OC(/C(/[2H])=C(\[2H])/C1C([2H])=C([2H])C([2H])=C([2H])C=1[2H])=O

Computed Properties

  • Exact Mass: 155.096366715g/mol
  • Monoisotopic Mass: 155.096366715g/mol
  • Isotope Atom Count: 7
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 155
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Color/Form: solid
  • Melting Point: 132-135?°C(lit.)
  • Boiling Point: 300?°C(lit.)
  • Flash Point: 100℃
  • PSA: 37.30000
  • LogP: 1.78440
  • Solubility: Not determined

2-Propenoic-2,3-d2acid, 3-(phenyl-d5)- (9CI) Security Information

  • WGK Germany:1
  • Hazard Category Code: 36/37/38
  • Safety Instruction: 26-36
  • Hazardous Material Identification: Xi

2-Propenoic-2,3-d2acid, 3-(phenyl-d5)- (9CI) Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd.
513954-500MG
2-Propenoic-2,3-d2acid, 3-(phenyl-d5)- (9CI)
308796-47-6
500mg
¥1089.92 2023-12-05
SHENG KE LU SI SHENG WU JI SHU
sc-237216-500 mg
trans-Cinnamic-d7 acid,
308796-47-6
500MG
¥940.00 2023-07-10
SHENG KE LU SI SHENG WU JI SHU
sc-237216-500mg
trans-Cinnamic-d7 acid,
308796-47-6
500mg
¥940.00 2023-09-05

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