Cas no 111454-85-4 (Pyridine,2-butoxy-3-ethoxy-)

Pyridine,2-butoxy-3-ethoxy- structure
Pyridine,2-butoxy-3-ethoxy- structure
Product Name:Pyridine,2-butoxy-3-ethoxy-
CAS No:111454-85-4
MF:C11H17NO2
MW:195.258183240891
CID:129270
PubChem ID:45116236
Update Time:2025-04-18

Pyridine,2-butoxy-3-ethoxy- Chemical and Physical Properties

Names and Identifiers

    • Pyridine,2-butoxy-3-ethoxy-
    • Pyridine, 2-butoxy-3-ethoxy- (9CI)
    • 111454-85-4
    • 2-Butoxy-3-ethoxypyridine
    • Inchi: 1S/C11H17NO2/c1-3-5-9-14-11-10(13-4-2)7-6-8-12-11/h6-8H,3-5,9H2,1-2H3
    • InChI Key: HSFXBVYCUIXLRH-UHFFFAOYSA-N
    • SMILES: O(C1C(=CC=CN=1)OCC)CCCC

Computed Properties

  • Exact Mass: 195.12601
  • Monoisotopic Mass: 195.126
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 6
  • Complexity: 141
  • 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: 31.4A^2
  • XLogP3: 2.7

Experimental Properties

  • PSA: 31.35
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