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4-N-HEXYLBENZONITRILE

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4-N-HEXYLBENZONITRILE

Catalog No: FT-0695638

CAS No: 29147-95-3

Chemical Name: 4-N-HEXYLBENZONITRILE
Molecular Formula: C13H17N
Molecular Weight: 187.28
InChI Key: QLSILVVVEOHLOG-UHFFFAOYSA-N
InChI: InChI=1S/C13H17N/c1-2-3-4-5-6-12-7-9-13(11-14)10-8-12/h7-10H,2-6H2,1H3

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

Product_Name:	4-Hexylbenzonitrile
Flash_Point:	133.1±14.0 °C
Melting_Point:	N/A
FW:	187.281
Density:	0.9±0.1 g/cm3
CAS:	29147-95-3
Bolling_Point:	295.8±19.0 °C at 760 mmHg
MF:	C13H17N

LogP:	4.77
Flash_Point:	133.1±14.0 °C
Refractive_Index:	1.507
FW:	187.281
Density:	0.9±0.1 g/cm3
Bolling_Point:	295.8±19.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :181 ', '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:	23.79000
MF:	C13H17N
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, KPa）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（Pa,25ºC）Unknow ', '12 . Saturated vapor pressure（KPa,25ºC）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:	0.0±0.6 mmHg at 25°C
Exact_Mass:	187.136093