1-HEPTYL-4-(4-PYRIDYL)PYRIDINIUM BROMIDE

Catalog No: FT-0639528

CAS No: 39127-10-1

Chemical Name: 1-HEPTYL-4-(4-PYRIDYL)PYRIDINIUM BROMIDE
Molecular Formula: C17H23BrN2
Molecular Weight: 335.3
InChI Key: GBJHAEPTEZMDHU-UHFFFAOYSA-M
InChI: InChI=1S/C17H23N2.BrH/c1-2-3-4-5-6-13-19-14-9-17(10-15-19)16-7-11-18-12-8-16;/h7-12,14-15H,2-6,13H2,1H3;1H/q+1;/p-1

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

Symbol:	Warning
FW:	335.28200
Density:	N/A
CAS:	39127-10-1
Bolling_Point:	N/A
Product_Name:	1-Heptyl-4-(4-pyridyl)pyridinium bromide
Melting_Point:	125-128ºC(lit.)
Flash_Point:	N/A
MF:	C17H23BrN2

Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :7 ', '5. Isotope Atom Count :N/A ', '6. TPSA 168 ', '7. Heavy Atom Count :20 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :215 ', '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 :2']
LogP:	1.01050
Melting_Point:	125-128ºC(lit.)
FW:	335.28200
PSA:	16.77000
MF:	C17H23BrN2
Exact_Mass:	334.10400

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
Hazard_Codes:	Xi: Irritant;
Risk_Statements(EU):	36/37/38
Safety_Statements:	26-37/39
Symbol:	Warning
Warning_Statement:	P261-P305 + P351 + P338
RIDADR:	NONH for all modes of transport
HS_Code:	2933399090