Cas no 13657-09-5 (Benzene-d5)

Benzene-d5 structure
Benzene-d5 structure
Product Name:Benzene-d5
CAS No:13657-09-5
MF:C6H6
MW:83.1426501274109
CID:137943
PubChem ID:11332416
Update Time:2025-04-19

Benzene-d5 Chemical and Physical Properties

Names and Identifiers

    • Benzene-1,2,3,4,5-d5
    • Benzene-D5
    • 485330_ALDRICH
    • I14-39802
    • pentadeuterio-benzene
    • Pentadeuterio-benzol
    • BENZENE-D5, 99 ATOM % D
    • DTXSID70462530
    • J-006867
    • 1,2,3,4,5-pentadeuteriobenzene
    • D98474
    • (?H?)benzene
    • 13657-09-5
    • AKOS015910218
    • AMY006
    • DB-318646
    • Benzene-d5
    • Inchi: 1S/C6H6/c1-2-4-6-5-3-1/h1-6H/i1D,2D,3D,4D,5D
    • InChI Key: UHOVQNZJYSORNB-RALIUCGRSA-N
    • SMILES: C1([2H])C([2H])=C([2H])C=C([2H])C=1[2H]

Computed Properties

  • Exact Mass: 83.0783339211g/mol
  • Monoisotopic Mass: 83.0783339211g/mol
  • Isotope Atom Count: 5
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 6
  • Rotatable Bond Count: 0
  • Complexity: 27
  • 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: 0?2

Experimental Properties

  • Color/Form: Not available
  • Density: 0.930?g/mL?at 25?°C
  • Melting Point: 5.5?°C(lit.)
  • Boiling Point: 80?°C(lit.)
  • Flash Point: 12?°F
  • Refractive Index: n20/D 1.498(lit.)
  • Solubility: Not available

Benzene-d5 Security Information

Benzene-d5 Pricemore >>

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