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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 g/mol
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
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