Cas no 102879-48-1 (3-Propylpyridine-2-carboxylic acid)

3-Propylpyridine-2-carboxylic acid structure
102879-48-1 structure
Product Name:3-Propylpyridine-2-carboxylic acid
CAS No:102879-48-1
MF:C9H11NO2
MW:165.189142465591
MDL:MFCD20646417
CID:125337
PubChem ID:57357275
Update Time:2025-04-18

3-Propylpyridine-2-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2-Pyridinecarboxylicacid, 3-propyl-
    • Picolinicacid, 3-propyl- (6CI)
    • 3-propylpyridine-2-carboxylic acid
    • Picolinic acid, 3-propyl- (6CI)
    • 3-Propyl-2-pyridinecarboxylic acid
    • SCHEMBL22653038
    • 3-Propylpicolinic acid
    • DTXSID60723607
    • AS-62104
    • CEA87948
    • 102879-48-1
    • D93328
    • AKOS024125740
    • 3-Propylpyridine-2-carboxylic acid
    • MDL： MFCD20646417
    • Inchi： 1S/C9H11NO2/c1-2-4-7-5-3-6-10-8(7)9(11)12/h3,5-6H,2,4H2,1H3,(H,11,12)
    • InChI Key： RGBUVKDPPSGIGH-UHFFFAOYSA-N
    • SMILES： OC(C1C(=CC=CN=1)CCC)=O

Computed Properties

  • Exact Mass: 165.07903
  • Monoisotopic Mass: 165.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 159
  • 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
  • Topological Polar Surface Area: 50.2
  • XLogP3: 2.1

Experimental Properties

  • PSA: 50.19
  • LogP: 1.73230

3-Propylpyridine-2-carboxylic acid Pricemore >>

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