ISOPROPYLIDENEMALONONITRILE

Catalog No: FT-0627488

CAS No: 13166-10-4

Chemical Name: ISOPROPYLIDENEMALONONITRILE
Molecular Formula: C6H6N2
Molecular Weight: 106.13
InChI Key: NVBHWAQBDJEGEO-UHFFFAOYSA-N
InChI: InChI=1S/C6H6N2/c1-5(2)6(3-7)4-8/h1-2H3

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:	UNII:95GG0L5YGE
Flash_Point:	101ºC
Melting_Point:	N/A
FW:	231.719
Density:	0.96
CAS:	13166-10-4
Bolling_Point:	112ºC 25mm
MF:	C11H18ClNO2

Molecular_Structure:	['1 . Molar refractive index 2941 ', '2 . Molar volume （m3/mol）1075 ', '3 . Parachor （902K）2670 ', '4 . Surface tension 379 ', '5 . Polarizability 1166']
LogP:	3.09580
Flash_Point:	101ºC
Refractive_Index:	1.459
FW:	231.719
Density:	0.96
Bolling_Point:	112ºC 25mm
Computational_Chemistry:	['1. XlogP :14 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 476 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :183 ', '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']
PSA:	44.48000
MF:	C11H18ClNO2
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL, 25 ℃ ）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC，2mmHg）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（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 Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow']
Vapor_Pressure:	0.146mmHg at 25°C
Exact_Mass:	231.102600