Cas no 100131-53-1 (Pyridine, 3-(2-methylbutyl)- (6CI))

Pyridine, 3-(2-methylbutyl)- (6CI) structure
100131-53-1 structure
Product Name:Pyridine, 3-(2-methylbutyl)- (6CI)
CAS No:100131-53-1
MF:C10H15N
MW:149.232802629471
CID:892860
PubChem ID:13024972
Update Time:2025-04-19

Pyridine, 3-(2-methylbutyl)- (6CI) Chemical and Physical Properties

Names and Identifiers

    • Pyridine, 3-(2-methylbutyl)- (6CI)
    • Inchi: 1S/C10H15N/c1-3-9(2)7-10-5-4-6-11-8-10/h4-6,8-9H,3,7H2,1-2H3
    • InChI Key: HEPPEJMGBGUFBV-UHFFFAOYSA-N
    • SMILES: N1C=CC=C(C=1)CC(C)CC

Computed Properties

  • Exact Mass: 149.120449g/mol
  • Monoisotopic Mass: 149.120449g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 3
  • Complexity: 101
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Molecular Weight: 149.23g/mol
  • XLogP3: 3
  • Topological Polar Surface Area: 12.9?2
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