Cas no 185335-30-2 (5-Bromo-4-chloro-3-indoxyl phosphate, potassium salt)

5-Bromo-4-chloro-3-indoxyl phosphate, potassium salt structure
185335-30-2 structure
Product Name:5-Bromo-4-chloro-3-indoxyl phosphate, potassium salt
CAS No:185335-30-2
MF:C8H5BrClKNO4P
MW:364.558662176132
CID:114527
Update Time:2023-08-02

5-Bromo-4-chloro-3-indoxyl phosphate, potassium salt Chemical and Physical Properties

Names and Identifiers

    • 1H-Indol-3-ol,5-bromo-4-chloro-, dihydrogen phosphate (ester), potassium salt (9CI)
    • 5-BROMO-4-CHLORO-3-INDOLYL PHOSPHATE DIPOTASSIUM SALT
    • 5-BROMO-4-CHLORO-3-INDOXYL PHOSPHATE, POTASSIUM SALT
    • 5-BROMO-4-CHLOROINDOL-3-YL PHOSPHATE DIPOTASSIUM SALT
    • BCIP 2 K
    • X-PHOS 2 K
    • X-PHOSPHATE POTASSIUM SALT
    • BCIP
    • X-PHOS K
    • BCIP DIPOTASSIUM SALT
    • X-PHOSPHATE DIPOTASSIUM SALT
    • BCIPT
    • Potassium 5-bromo-4-chloro-1H-indol-3-yl phosphate(x:1)
    • Potassium 5-bromo-4-chloro-1H-indol-3-yl hydrogen phosphate
    • BCIP/BCIPT
    • 5-Bromo-4-chloro-3-indoxyl phosphate, potassium salt
    • Inchi: 1S/C8H6BrClNO4P.K/c9-4-1-2-5-7(8(4)10)6(3-11-5)15-16(12,13)14;/h1-3,11H,(H2,12,13,14);/q;+1/p-1
    • InChI Key: AKUABRWUZQTUPM-UHFFFAOYSA-M
    • SMILES: BrC1C=CC2=C(C=1Cl)C(=CN2)OP(=O)(O)[O-].[K+]

Computed Properties

  • Exact Mass: 362.84652 g/mol
  • Monoisotopic Mass: 362.84652 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 326
  • 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: 85.4
  • Molecular Weight: 364.56

5-Bromo-4-chloro-3-indoxyl phosphate, potassium salt Security Information

  • WGK Germany:1
  • Hazard Category Code: 36
  • Safety Instruction: 26
  • Risk Phrases:R36
  • Safety Term:S26
  • Storage Condition:?20°C
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