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4-butoxybenzene-1,2-dicarbonitrile

Catalog No: FT-0756450

CAS No: 81560-32-9

Chemical Name: 4-butoxybenzene-1,2-dicarbonitrile
Molecular Formula: C12H12N2O
Molecular Weight: 200.24
InChI Key: AVGCGXBXMPWLOW-UHFFFAOYSA-N
InChI: InChI=1S/C12H12N2O/c1-2-3-6-15-12-5-4-10(8-13)11(7-12)9-14/h4-5,7H,2-3,6H2,1H3

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

Bolling_Point:	376.7±32.0 °C at 760 mmHg
CAS:	81560-32-9
MF:	C12H12N2O
Density:	1.1±0.1 g/cm3
Melting_Point:	46ºC
Product_Name:	4-Butoxyphthalonitrile
Flash_Point:	156.1±18.0 °C
FW:	200.236

MF:	C12H12N2O
Density:	1.1±0.1 g/cm3
Computational_Chemistry:	['1. XlogP :26 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 568 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :283 ', '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']
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL25 ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）46 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC2mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（℉）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,）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（正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 不能溶解于Water ']
Exact_Mass:	200.094955
Vapor_Pressure:	0.0±0.9 mmHg at 25°C
Flash_Point:	156.1±18.0 °C
PSA:	56.81000
LogP:	2.76
Melting_Point:	46ºC
Bolling_Point:	376.7±32.0 °C at 760 mmHg
FW:	200.236
Refractive_Index:	1.530