L-3-BENZOTHIENYLALANINE

Catalog No: FT-0649688

CAS No: 72120-71-9

Molecular Formula: 221.28
Formula Weight: C11H11NO2S
Inchl Key: GAUUPDQWKHTCAX-VIFPVBQESA-N
Inchl: InChI=1S/C11H11NO2S/c12-9(11(13)14)5-7-6-15-10-4-2-1-3-8(7)10/h1-4,6,9H,5,12H2,(H,13,14)/t9-/m0/s1

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Base Information
Chemical Information

Melting_Point:	N/A
CAS:	72120-71-9
MF:	C11H11NO2S
Flash_Point:	205.8±25.9 °C
Product_Name:	3-(1-Benzothiophen-3-yl)-L-alanine
Density:	1.4±0.1 g/cm3
FW:	221.275
Bolling_Point:	416.7±35.0 °C at 760 mmHg

Refractive_Index:	1.692
Vapor_Pressure:	0.0±1.0 mmHg at 25°C
Flash_Point:	205.8±25.9 °C
LogP:	3.28
Bolling_Point:	416.7±35.0 °C at 760 mmHg
FW:	221.275
PSA:	91.56000
Computational_Chemistry:	['1 . XlogP -02 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 3 ', '5 . TPSA 633 ', '6 . Heavy Atom Count 15 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 247 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
MF:	C11H11NO2S
Exact_Mass:	221.051056
Molecular_Structure:	['1 . Molar refractive index 6172 ', '2 . Molar volume （m3/mol）1610 ', '3 . Parachor （902K）4588 ', '4 . Surface tension 659 ', '5 . Polarizability （10 -24cm 3）2446']
Density:	1.4±0.1 g/cm3
More_Info:	['1 . Appearance 。 ', '2 . Density（g/mL,25/4℃） ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC） ', '5 . Boiling point（ºC,Atmospheric pressure） ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC） Unknow ', '15 . Critical pressure（KPa） Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility 。']