Ethyl 2-amino-5,6,7,8-tetrahydro-4H-cyclohepta-[b]thiophene-3-carboxylate


Catalog No:   FT-0678503

CAS No:   40106-13-6

  • Chemical Name:  Ethyl 2-amino-5,6,7,8-tetrahydro-4H-cyclohepta-[b]thiophene-3-carboxylate
  • Molecular Formula:  C12H17NO2S
  • Molecular Weight:  239.34
  • InChI Key:  XTUHIGALMIGZST-UHFFFAOYSA-N
  • InChI:  InChI=1S/C12H17NO2S/c1-2-15-12(14)10-8-6-4-3-5-7-9(8)16-11(10)13/h2-7,13H2,1H3

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: ethyl 2-amino-5,6,7,8-tetrahydro-4h-cyclohepta[b]thiophene-3-carboxylate
Flash_Point: 207.5ºC
Melting_Point: 89-90ºC
FW: 239.33400
Density: 1.195g/cm3
CAS: 40106-13-6
Bolling_Point: 419.4ºC at 760mmHg
MF: C12H17NO2S
Molecular_Structure: ['1 . Molar refractive index 626 ', '2 . Molar volume (m3/mol)1824 ', '3 . Parachor (902K)4871 ', '4 . Surface tension 508 ', '5 . Polarizability (10 -24cm 3)2460']
Flash_Point: 207.5ºC
Refractive_Index: 1.58
FW: 239.33400
Density: 1.195g/cm3
Bolling_Point: 419.4ºC at 760mmHg
Computational_Chemistry: ['1. XlogP :38 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :3 ', '6. TPSA 806 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :259 ', '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']
LogP: 3.35710
Melting_Point: 89-90ºC
PSA: 80.56000
MF: C12H17NO2S
More_Info: ['1 . Appearance 无可用 ', '2 . Density(g/mL,25/4℃)无可用 ', '3 . Relative vapor density(g/mL,Atmosphere =1)无可用 ', '4 . Melting point(ºC)89-90 ', '5 . Boiling point(ºC,Atmospheric pressure)无可用 ', '6 . Boiling point(ºC,52kPa)无可用 ', '7 . Refractive index无可用 ', '8 . Flash point(ºC)无可用 ', '9 . Specific rotation(º)无可用 ', '10 . Spontaneous ignition point or ignition temperature(ºC)无可用 ', '11 . Vapor pressure(kPa,25ºC)无可用 ', '12 . Saturated vapor pressure(kPa,60ºC)无可用 ', '13 . Combustion heat(KJ/mol)无可用 ', '14 . Critical temperature(ºC)无可用 ', '15 . Critical pressure(KPa)无可用 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion(%,V/V)无可用 ', '18 . Lower limit of explosion(%,V/V)无可用 ', '19 . Solubility 无可用']
Exact_Mass: 239.09800
Hazard_Codes: Xn,Xi
Risk_Statements(EU): R20/22
HS_Code: 2934999090
Safety_Statements: S22

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