Cas no 168567-40-6 (Ethyl, 1-methyl-1-(4-pyridinyl)- (9CI))

Ethyl, 1-methyl-1-(4-pyridinyl)- (9CI) structure
168567-40-6 structure
Product Name:Ethyl, 1-methyl-1-(4-pyridinyl)- (9CI)
CAS No:168567-40-6
MF:C8H10N
MW:120.171701908112
CID:905066
Update Time:2024-06-15

Ethyl, 1-methyl-1-(4-pyridinyl)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • Ethyl, 1-methyl-1-(4-pyridinyl)- (9CI)
    • Inchi: 1S/C8H10N/c1-7(2)8-3-5-9-6-4-8/h3-6H,1-2H3
    • InChI Key: FGFJMGIWCQCIGM-UHFFFAOYSA-N
    • SMILES: [C](C)(C1=CC=NC=C1)C |^1:0|

Computed Properties

  • Exact Mass: 120.081
  • Monoisotopic Mass: 120.081
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 2
  • Complexity: 79.8
  • 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
  • Surface Charge: 0
  • Tautomer Count: 2
  • XLogP3: -0.5
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