Cas no 1211530-21-0 (2-(4-bromopyridin-2-yl)acetic acid)

2-(4-bromopyridin-2-yl)acetic acid structure
1211530-21-0 structure
Product Name:2-(4-bromopyridin-2-yl)acetic acid
CAS No:1211530-21-0
MF:C7H6BrNO2
MW:216.032041072845
MDL:MFCD09999987
CID:1006965
PubChem ID:53403631
Update Time:2024-11-03

2-(4-bromopyridin-2-yl)acetic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(4-bromopyridin-2-yl)acetic acid
    • 4-Bromopyridine-2-acetic acid
    • A937723
    • SCHEMBL17396955
    • MFCD09999987
    • BS-14955
    • CS-0135290
    • C71755
    • AKOS022976897
    • 1211530-21-0
    • APOOYGKXZYWYOV-UHFFFAOYSA-N
    • 2-(4-BROMOPYRIDIN-2-YL)ACETICACID
    • (4-BROMOPYRIDIN-2-YL)ACETIC ACID
    • SY346169
    • DB-250626
    • 2-(4-Bromo-2-pyridyl)acetic Acid
    • MDL： MFCD09999987
    • Inchi： 1S/C7H6BrNO2/c8-5-1-2-9-6(3-5)4-7(10)11/h1-3H,4H2,(H,10,11)
    • InChI Key： APOOYGKXZYWYOV-UHFFFAOYSA-N
    • SMILES： BrC1C=CN=C(C=1)CC(=O)O

Computed Properties

  • Exact Mass: 214.95819g/mol
  • Monoisotopic Mass: 214.95819g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 151
  • 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: 1
  • Topological Polar Surface Area: 50.2?2

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