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(4-cyanophenyl) 4-pentylbenzoate

Catalog No: FT-0704668

CAS No: 49763-64-6

Chemical Name: (4-cyanophenyl) 4-pentylbenzoate
Molecular Formula: C19H19NO2
Molecular Weight: 293.4
InChI Key: WCCDNUMASFDPFO-UHFFFAOYSA-N
InChI: InChI=1S/C19H19NO2/c1-2-3-4-5-15-6-10-17(11-7-15)19(21)22-18-12-8-16(14-20)9-13-18/h6-13H,2-5H2,1H3

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

Melting_Point:	N/A
FW:	293.36000
CAS:	49763-64-6
MF:	C19H19NO2
Flash_Point:	225.3ºC
Product_Name:	(4-cyanophenyl) 4-pentylbenzoate
Bolling_Point:	453.3ºC at 760 mmHg
Density:	1.12 g/cm3

FW:	293.36000
Refractive_Index:	1.57
MF:	C19H19NO2
Exact_Mass:	293.14200
LogP:	4.51018
Bolling_Point:	453.3ºC at 760 mmHg
Density:	1.12 g/cm3
PSA:	50.09000
Computational_Chemistry:	['1. XlogP :55 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :7 ', '5. Isotope Atom Count :3 ', '6. TPSA 501 ', '7. Heavy Atom Count :22 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :382 ', '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']
Flash_Point:	225.3ºC