Home Aminos 2-[4-(Phenylamino)phenyl]-2?5-isoquinolin-2-ylium; tetrafluoroboranuide

2-[4-(Phenylamino)phenyl]-2?5-isoquinolin-2-ylium; tetrafluoroboranuide

CAS No.:
104312-81-4
Catalog Number:
AG01F4S7
Molecular Formula:
C21H17BF4N2
Molecular Weight:
384.1777
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
95%
1 week
United States
$163
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Product Description
Catalog Number:
AG01F4S7
Chemical Name:
2-[4-(Phenylamino)phenyl]-2?5-isoquinolin-2-ylium; tetrafluoroboranuide
CAS Number:
104312-81-4
Molecular Formula:
C21H17BF4N2
Molecular Weight:
384.1777
MDL Number:
MFCD00972442
IUPAC Name:
4-isoquinolin-2-ium-2-yl-N-phenylaniline;tetrafluoroborate
InChI:
InChI=1S/C21H17N2.BF4/c1-2-8-19(9-3-1)22-20-10-12-21(13-11-20)23-15-14-17-6-4-5-7-18(17)16-23;2-1(3,4)5/h1-16,22H;/q+1;-1
InChI Key:
RJEBLEWYDHZPIR-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Nc1ccc(cc1)[n+]1ccc2c(c1)cccc2.F[B-](F)(F)F
Properties
Complexity:
374  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.142g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
384.185g/mol
Monoisotopic Mass:
384.142g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
15.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties