Cas no 157590-60-8 (4-Bromo-5-(trifluoromethyl)benzene-1,2-diamine)

4-Bromo-5-(trifluoromethyl)benzene-1,2-diamine structure
157590-60-8 structure
Product Name:4-Bromo-5-(trifluoromethyl)benzene-1,2-diamine
CAS No:157590-60-8
MF:C7H6BrF3N2
MW:255.035151004791
MDL:MFCD09263998
CID:843006
PubChem ID:10538921
Update Time:2024-11-01

4-Bromo-5-(trifluoromethyl)benzene-1,2-diamine Chemical and Physical Properties

Names and Identifiers

    • 4-Bromo-5-(trifluoromethyl)benzene-1,2-diamine
    • 2-Amino-4-bromo-5-(trifluoromethyl)phenylamine
    • 4‐BROMO‐5‐TRIFLUOROMETHYLBENZENE‐1,2‐DIAMINE
    • 4-Bromo-5-fluorobenzene-1,2-diamine
    • AB50366
    • F51085
    • SCHEMBL848016
    • CS-0087936
    • 1,2-Diamino-4-bromo-5-(trifluoromethyl)benzene
    • 4-Bromo-5-trifluoromethyl-benzene-1,2-diamine
    • DTXSID60441495
    • MFCD09263998
    • AKOS005073501
    • J-514760
    • SY260309
    • MD-0073
    • 1,2-Benzenediamine, 4-bromo-5-(trifluoromethyl)-
    • 4-Bromo-5-(trifluoromethyl)-1,2-benzenediamine
    • 157590-60-8
    • MDL: MFCD09263998
    • Inchi: 1S/C7H6BrF3N2/c8-4-2-6(13)5(12)1-3(4)7(9,10)11/h1-2H,12-13H2
    • InChI Key: AKIMDXKCJKECRS-UHFFFAOYSA-N
    • SMILES: BrC1=CC(=C(C=C1C(F)(F)F)N)N

Computed Properties

  • Exact Mass: 253.96700
  • Monoisotopic Mass: 253.96665g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 185
  • 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: 2.1
  • Topological Polar Surface Area: 52?2

Experimental Properties

  • PSA: 52.04000
  • LogP: 3.79470

4-Bromo-5-(trifluoromethyl)benzene-1,2-diamine Security Information

  • HazardClass:IRRITANT

4-Bromo-5-(trifluoromethyl)benzene-1,2-diamine Pricemore >>

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