Cas no 152213-66-6 (2-(6-Bromo-1H-indol-3-yl)acetic acid)

2-(6-Bromo-1H-indol-3-yl)acetic acid structure
152213-66-6 structure
Product Name:2-(6-Bromo-1H-indol-3-yl)acetic acid
CAS No:152213-66-6
MF:C10H8BrNO2
MW:254.080021858215
MDL:MFCD09954810
CID:99318
PubChem ID:22485713
Update Time:2025-04-18

2-(6-Bromo-1H-indol-3-yl)acetic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(6-Bromo-1H-indol-3-yl)acetic acid
    • 1H-Indole-3-aceticacid, 6-bromo-
    • 1H-Indole-3-aceticacid,6-bromo-(9CI)
    • 6-Bromoindole-3-acetic acid
    • ACMC-209xgu
    • ANW-47644
    • CTK0G9538
    • SR 069
    • SureCN4484622
    • 6-broMo-1H-indole-3-acetic acid
    • (6-broMo-1H-indol-3-yl)acetic acid
    • MFCD09954810
    • A884034
    • 6-Bromo-1H-indole-3-aceticacid
    • 2-Bromo-1H-indole-3-aceticacid methyl ester
    • AS-47705
    • 152213-66-6
    • F2169-0442
    • 1h-indole-3-acetic acid,6-bromo-
    • SCHEMBL4484622
    • 2-(6-Bromo-1H-indol-3-yl)aceticacid
    • BSYVHEMZTXJMFN-UHFFFAOYSA-N
    • Z978942580
    • FT-0770177
    • F15643
    • DTXSID40626081
    • EN300-110327
    • SY043026
    • CS-0308168
    • 2-(6-Bromo-1H-indol -3-yl)acetic acid
    • AKOS011637571
    • STL559115
    • BBL036736
    • DB-063937
    • MDL: MFCD09954810
    • Inchi: 1S/C10H8BrNO2/c11-7-1-2-8-6(3-10(13)14)5-12-9(8)4-7/h1-2,4-5,12H,3H2,(H,13,14)
    • InChI Key: BSYVHEMZTXJMFN-UHFFFAOYSA-N
    • SMILES: BrC1C=CC2=C(C=1)NC=C2CC(=O)O

Computed Properties

  • Exact Mass: 252.97384
  • Monoisotopic Mass: 252.97384g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 234
  • 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: 53.1?2

Experimental Properties

  • Density: 1.746±0.06 g/cm3 (20 oC 760 Torr),
  • Solubility: Very slightly soluble (0.79 g/l) (25 o C),
  • PSA: 53.09

2-(6-Bromo-1H-indol-3-yl)acetic acid Pricemore >>

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