Chemical Name: 5-Benzyloxyindole-3-acetonitrile
Molecular Formula: C17H14N2O
Molecular Weight: 262.3
InChI Key: ADPRFNVFBYHCJQ-UHFFFAOYSA-N
InChI: InChI=1S/C17H14N2O/c18-9-8-14-11-19-17-7-6-15(10-16(14)17)20-12-13-4-2-1-3-5-13/h1-7,10-11,19H,8,12H2

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:	5-Benzyloxyindole-3-acetonitrile
Flash_Point:	257.6ºC
Melting_Point:	76-80 °C(lit.)
FW:	262.30600
Density:	1.232 g/cm3
CAS:	2436-15-9
Bolling_Point:	502.3ºC at 760 mmHg
MF:	C17H14N2O

Molecular_Structure:	['1 . Molar refractive index 7915 ', '2 . Molar volume （m3/mol）2127 ', '3 . Parachor （902K）5844 ', '4 . Surface tension 569 ', '5 . Dielectric constant （F/m）无可用 ', '6 偶极距（D）无可用 ', '7 . Polarizability （10 -24cm 3）3138']
LogP:	3.81298
Flash_Point:	257.6ºC
Refractive_Index:	1.666
FW:	262.30600
Density:	1.232 g/cm3
Bolling_Point:	502.3ºC at 760 mmHg
Computational_Chemistry:	['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 488 ', '7. Heavy Atom Count :20 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :355 ', '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']
Melting_Point:	76-80 °C(lit.)
PSA:	48.81000
MF:	C17H14N2O
More_Info:	['1 . Appearance 类White 结晶粉末 ', '2 . Density（g/mL 25ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）76-80 ', '5 . Boiling point（ºC，18mmHg）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index（°，n20/D）Unknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,20ºC）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 （25℃）Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility (mg/mL, 25 ºC )Water Unknow']
Vapor_Pressure:	3.21E-10mmHg at 25°C
Exact_Mass:	262.11100

Personal_Protective_Equipment:	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
RIDADR:	NONH for all modes of transport
Hazard_Codes:	Xi: Irritant;
WGK_Germany:	3