Cas no 778535-15-2 ((2,5,6-Trimethyl-benzoimidazol-1-yl)-acetic acid)

(2,5,6-Trimethyl-benzoimidazol-1-yl)-acetic acid structure
778535-15-2 structure
Product Name:(2,5,6-Trimethyl-benzoimidazol-1-yl)-acetic acid
CAS No:778535-15-2
MF:C12H14N2O2
MW:218.251762866974
CID:2296449
PubChem ID:3159720
Update Time:2025-04-21

(2,5,6-Trimethyl-benzoimidazol-1-yl)-acetic acid Chemical and Physical Properties

Names and Identifiers

    • (2,5,6-Trimethyl-benzoimidazol-1-yl)-acetic acid
    • 2-(2,5,6-trimethylbenzimidazol-1-yl)acetic acid
    • 2-(2,5,6-Trimethyl-1H-benzo[d]imidazol-1-yl)acetic acid
    • SR-01000368643
    • SR-01000368643-1
    • (2,5,6-trimethyl-1,3-benzodiazol-1-yl)acetic acid
    • AKOS000303347
    • 778535-15-2
    • MDL: MFCD07186458
    • Inchi: 1S/C12H14N2O2/c1-7-4-10-11(5-8(7)2)14(6-12(15)16)9(3)13-10/h4-5H,6H2,1-3H3,(H,15,16)
    • InChI Key: FROBVNDNVPFNRM-UHFFFAOYSA-N
    • SMILES: OC(CN1C(C)=NC2C=C(C)C(C)=CC1=2)=O

Computed Properties

  • Exact Mass: 218.105527694Da
  • Monoisotopic Mass: 218.105527694Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 282
  • 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: 2.3
  • Topological Polar Surface Area: 55.1?2

(2,5,6-Trimethyl-benzoimidazol-1-yl)-acetic acid Pricemore >>

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