2,2-dimethylpropanethioamide (CAS: 630-22-8) - Chemical Structure and Molecular Formula
2,2-dimethylpropanethioamide (CAS: 630-22-8) - Chemical Structure Thumbnail

2,2-dimethylpropanethioamide

Catalog No:   FT-0698711

CAS No:   630-22-8

  • Chemical Name:  2,2-dimethylpropanethioamide
  • Molecular Formula:  C5H11NS
  • Molecular Weight:  117.22 g/mol
  • InChI Key:  FJZJUSOFGBXHCV-UHFFFAOYSA-N
  • InChI:  InChI=1S/C5H11NS/c1-5(2,3)4(6)7/h1-3H3,(H2,6,7)
Product pricing and availability information
Assay Pack Size Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Product_Name: 2,2,2-Trimethylthioacetamide
Bolling_Point: 162.1±23.0 °C at 760 mmHg
Density: 1.0±0.1 g/cm3
MF: C5H11NS
CAS: 630-22-8
Melting_Point: 117-119ºC (ethyl acetate hexane )
Flash_Point: 51.9±22.6 °C
FW: 117.213
MF: C5H11NS
Bolling_Point: 162.1±23.0 °C at 760 mmHg
Exact_Mass: 117.061218
Melting_Point: 117-119ºC (ethyl acetate hexane )
Refractive_Index: 1.513
PSA: 58.11000
Flash_Point: 51.9±22.6 °C
Computational_Chemistry: ['1. XlogP :11 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :2 ', '6. TPSA :581 ', '7. Heavy Atom Count :7 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :806 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Density: 1.0±0.1 g/cm3
FW: 117.213
LogP: 0.97
Vapor_Pressure: 2.2±0.3 mmHg at 25°C

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