Cas no 64420-97-9 (2-Nitrobiphenyl-2’,3’,4’,5’,6’-d5)

2-Nitrobiphenyl-2',3',4',5',6'-d5 is a highly pure isotopically labeled compound, featuring deuterium substitution. This unique labeling allows for precise isotopic tracing in complex chemical reactions. Its high purity and isotopic specificity make it ideal for advanced analytical applications, such as nuclear magnetic resonance (NMR) spectroscopy, where accurate isotope ratio measurements are crucial.
2-Nitrobiphenyl-2’,3’,4’,5’,6’-d5 structure
64420-97-9 structure
Product Name:2-Nitrobiphenyl-2’,3’,4’,5’,6’-d5
CAS No:64420-97-9
MF:C12H9NO2
MW:204.236171483994
CID:826424
PubChem ID:21770950
Update Time:2025-10-17

2-Nitrobiphenyl-2’,3’,4’,5’,6’-d5 Chemical and Physical Properties

Names and Identifiers

    • 2-NITROBIPHENYL-2',3',4',5',6'-D5
    • 2-Nitrobiphenyl-2’,3’,4’,5’,6’-d5
    • 2-Nitrobiphenyl-2’,3
    • 1,2,3,4,5-pentadeuterio-6-(2-nitrophenyl)benzene
    • AKOS030242587
    • 2-Nitro(2',3',4',5',6'-~2~H_5_)-1,1'-biphenyl
    • 64420-97-9
    • DTXSID60617870
    • 2-nitro(2',3',4',5',6'-?H?)-1,1'-biphenyl
    • Inchi: 1S/C12H9NO2/c14-13(15)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H/i1D,2D,3D,6D,7D
    • InChI Key: YOJKKXRJMXIKSR-FSTBWYLISA-N
    • SMILES: [O-][N+](C1C=CC=CC=1C1C([2H])=C([2H])C([2H])=C([2H])C=1[2H])=O

Computed Properties

  • Exact Mass: 204.09500
  • Monoisotopic Mass: 204.094712260g/mol
  • Isotope Atom Count: 5
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 218
  • 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
  • XLogP3: 3.7
  • Topological Polar Surface Area: 45.8?2

Experimental Properties

  • PSA: 45.82000
  • LogP: 3.78500

2-Nitrobiphenyl-2’,3’,4’,5’,6’-d5 Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
N495788-5mg
2-Nitrobiphenyl-2’,3’,4’,5’,6’-d5
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$ 161.00 2023-09-06
TRC
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$ 1206.00 2023-09-06

2-Nitrobiphenyl-2’,3’,4’,5’,6’-d5 Production Method

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