Cas no 780800-74-0 (3-(propan-2-yl)pyridine-2-carbaldehyde)

3-(propan-2-yl)pyridine-2-carbaldehyde structure
780800-74-0 structure
Product Name:3-(propan-2-yl)pyridine-2-carbaldehyde
CAS No:780800-74-0
MF:C9H11NO
MW:149.189742326736
CID:553775
PubChem ID:45083635
Update Time:2025-04-19

3-(propan-2-yl)pyridine-2-carbaldehyde Chemical and Physical Properties

Names and Identifiers

    • 2-Pyridinecarboxaldehyde,3-(1-methylethyl)-
    • 2-Pyridinecarboxaldehyde, 3-(1-methylethyl)- (9CI)
    • 3-propan-2-ylpyridine-2-carbaldehyde
    • 3-(propan-2-yl)pyridine-2-carbaldehyde
    • 3 -isopropyl-pyridine-2-carbaldehyde
    • 3-ISOPROPYLPICOLINALDEHYDE
    • 3-(1-METHYLETHYL)-2-PYRIDINECARBOXALDEHYDE
    • IDULKRZSZVQVJN-UHFFFAOYSA-N
    • 3-isopropyl-pyridine-2-carbaldehyde
    • 3-isopropyl-pyridine-2-carboxaldehyde
    • AT24574
    • SCHEMBL2082260
    • AB65916
    • DTXSID301265012
    • GS2408
    • 780800-74-0
    • Inchi: 1S/C9H11NO/c1-7(2)8-4-3-5-10-9(8)6-11/h3-7H,1-2H3
    • InChI Key: IDULKRZSZVQVJN-UHFFFAOYSA-N
    • SMILES: O=CC1C(=CC=CN=1)C(C)C

Computed Properties

  • Exact Mass: 149.084063974g/mol
  • Monoisotopic Mass: 149.084063974g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 134
  • 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: 1.8
  • Topological Polar Surface Area: 30?2

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