Chemical Name: N,N-Bis(cyanoethyl)aniline
Molecular Formula: C12H13N3
Molecular Weight: 199.25
InChI Key: NSVHSAUVIFTVPN-UHFFFAOYSA-N
InChI: InChI=1S/C12H13N3/c13-8-4-10-15(11-5-9-14)12-6-2-1-3-7-12/h1-3,6-7H,4-5,10-11H2

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:	3-[N-(2-cyanoethyl)anilino]propanenitrile
Flash_Point:	189ºC
Melting_Point:	81-84 °C(lit.)
FW:	199.25200
Density:	1.105g/cm3
CAS:	1555-66-4
Bolling_Point:	175 - 180 (0.3 torr)
MF:	C12H13N3

Molecular_Structure:	['1 . Molar refractive index 5892 ', '2 . Molar volume （m3/mol）1802 ', '3 . Parachor （902K）4850 ', '4 . Surface tension 524 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10 -24cm 3）无可用 ', '7 . Polarizability 2335']
Flash_Point:	189ºC
Refractive_Index:	1.567
FW:	199.25200
Density:	1.105g/cm3
Bolling_Point:	175 - 180 (0.3 torr)
Computational_Chemistry:	['1. XlogP :14 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :N/A ', '6. TPSA 508 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :241 ', '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:	2.32036
Melting_Point:	81-84 °C(lit.)
PSA:	50.82000
MF:	C12H13N3
More_Info:	['1 . Appearance White 结晶粉末。 ', '2 . Density（g/mL,25/4℃） Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）81-84 ', '5 . Boiling point（ºC,Atmospheric pressure）175-180 ', '6 . Boiling point（ºC,52kPa） Unknow ', '7 . Refractive index Unknow ', '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 易Soluble in 有机溶剂稀酸稀碱，Insoluble in Water 。']
Vapor_Pressure:	5.35E-07mmHg at 25°C
Exact_Mass:	199.11100