Cas no 2961-61-7 (Benzonitrile,4-hydroxy-3,5-diiodo-, lithium salt (1:1))

Benzonitrile,4-hydroxy-3,5-diiodo-, lithium salt (1:1) structure
2961-61-7 structure
Product Name:Benzonitrile,4-hydroxy-3,5-diiodo-, lithium salt (1:1)
CAS No:2961-61-7
MF:C7H2I2LiNO
MW:376.846826076508
CID:279605
PubChem ID:23691010
Update Time:2025-04-19

Benzonitrile,4-hydroxy-3,5-diiodo-, lithium salt (1:1) Chemical and Physical Properties

Names and Identifiers

    • Benzonitrile,4-hydroxy-3,5-diiodo-, lithium salt (1:1)
    • lithium,4-cyano-2,6-diiodophenolate
    • 3,5-Diiodo-4-hydroxybenzonitrile, lithium salt
    • 3,5-Dijod-4-hydroxy-benzonitrile lithiumsalz [German]
    • 4-Cyano-2,6-dijodphenol lithiumsalz [German]
    • BENZONITRILE, 3,5-DIIODO-4-HYDROXY-, LITHIUM SALT
    • CTK4G3556
    • Ioxynil, lithium salt
    • Ioxynil-lithium
    • Ioxynil-lithium [ISO]
    • SureCN5933488
    • SCHEMBL5933488
    • DTXSID3042055
    • 3,5-Dijod-4-hydroxy-benzonitrile lithiumsalz
    • BENZONITRILE, 4-HYDROXY-3,5-DIIODO-, LITHIUM SALT (1:1)
    • Benzonitrile, 4-hydroxy-3,5-diiodo-, lithium salt
    • 2961-61-7
    • (4-CYANO-2,6-DIIODOPHENOXY) LITHIUM
    • UNII-E58WQC6Q6R
    • 4-Cyano-2,6-dijodphenol lithiumsalz
    • E58WQC6Q6R
    • IOXYNIL LITHIUM [MI]
    • Q27276881
    • Inchi: 1S/C7H3I2NO.Li/c8-5-1-4(3-10)2-6(9)7(5)11;/h1-2,11H;/q;+1/p-1
    • InChI Key: WMMYHMKUTCMAIJ-UHFFFAOYSA-M
    • SMILES: IC1C=C(C#N)C=C(C=1[O-])I.[Li+]

Computed Properties

  • Exact Mass: 375.83678
  • Monoisotopic Mass: 376.838579
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 181
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 46.8

Experimental Properties

  • Boiling Point: 282.6°Cat760mmHg
  • Flash Point: 124.7°C
  • PSA: 46.85
Recommended suppliers
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Beyond Pharmaceutical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shandong Jing Kun Chemical Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shandong Jing Kun Chemical Co.,Ltd.
Shandong Feiyang Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shandong Feiyang Chemical Co., Ltd
Shanghai Bent Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk