Cas no 61327-65-9 (pyrimidine, 2-butyl- (9ci))

pyrimidine, 2-butyl- (9ci) structure
pyrimidine, 2-butyl- (9ci) structure
Product Name:pyrimidine, 2-butyl- (9ci)
CAS No:61327-65-9
MF:C8H12N2
MW:136.194281578064
CID:954330
PubChem ID:12343989
Update Time:2025-04-19

pyrimidine, 2-butyl- (9ci) Chemical and Physical Properties

Names and Identifiers

    • pyrimidine, 2-butyl- (9ci)
    • butylpyrimidine
    • 61327-65-9
    • 2-butylpyrimidine
    • SCHEMBL1108475
    • Inchi: 1S/C8H12N2/c1-2-3-5-8-9-6-4-7-10-8/h4,6-7H,2-3,5H2,1H3
    • InChI Key: ZXAIYDYMRWTSSV-UHFFFAOYSA-N
    • SMILES: N1C=CC=NC=1CCCC

Computed Properties

  • Exact Mass: 136.100048391g/mol
  • Monoisotopic Mass: 136.100048391g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 3
  • Complexity: 77.3
  • 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: 1.9
  • Topological Polar Surface Area: 25.8?2
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