Cas no 644950-38-9 (2-Thiazolemethanamine,N-methyl-4-(1-methylethyl)-)

2-Thiazolemethanamine,N-methyl-4-(1-methylethyl)- structure
644950-38-9 structure
Product Name:2-Thiazolemethanamine,N-methyl-4-(1-methylethyl)-
CAS No:644950-38-9
MF:C8H14N2S
MW:170.275160312653
CID:502861
PubChem ID:4372195
Update Time:2025-04-19

2-Thiazolemethanamine,N-methyl-4-(1-methylethyl)- Chemical and Physical Properties

Names and Identifiers

    • 2-Thiazolemethanamine,N-methyl-4-(1-methylethyl)-
    • 2-Thiazolemethanamine,N-methyl-4-(1-methylethyl)-(9CI)
    • N-methyl-4-(1-methylethyl)-2-Thiazolemethanamine
    • 644950-38-9
    • AKOS006148469
    • FT-0750001
    • Inchi: 1S/C8H14N2S/c1-6(2)7-5-11-8(10-7)4-9-3/h5-6,9H,4H2,1-3H3
    • InChI Key: PQKZAUQEMBDUKX-UHFFFAOYSA-N
    • SMILES: S1C=C(C(C)C)N=C1CNC

Computed Properties

  • Exact Mass: 170.08800
  • Monoisotopic Mass: 170.088
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 3
  • Complexity: 117
  • 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: 53.2A^2
  • XLogP3: 1.5

Experimental Properties

  • Density: 1.07
  • Boiling Point: 234.5 °C at 760 mmHg
  • Flash Point: 95.6 °C
  • PSA: 53.16000
  • LogP: 2.37680
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