Home Sulfos 4-(Ethoxycarbonyl)-N,N,N-trimethylbenzenaminium trifluoromethanesulfonate

4-(Ethoxycarbonyl)-N,N,N-trimethylbenzenaminium trifluoromethanesulfonate

CAS No.:
124915-06-6
Catalog Number:
AG000MVT
Molecular Formula:
C13H18F3NO5S
Molecular Weight:
357.3459
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95+%
1 week
United States
$188
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Product Description
Catalog Number:
AG000MVT
Chemical Name:
4-(Ethoxycarbonyl)-N,N,N-trimethylbenzenaminium trifluoromethanesulfonate
CAS Number:
124915-06-6
Molecular Formula:
C13H18F3NO5S
Molecular Weight:
357.3459
MDL Number:
MFCD17014669
IUPAC Name:
(4-ethoxycarbonylphenyl)-trimethylazanium;trifluoromethanesulfonate
InChI:
InChI=1S/C12H18NO2.CHF3O3S/c1-5-15-12(14)10-6-8-11(9-7-10)13(2,3)4;2-1(3,4)8(5,6)7/h6-9H,5H2,1-4H3;(H,5,6,7)/q+1;/p-1
InChI Key:
WLRXPMQGBKYWNJ-UHFFFAOYSA-M
SMILES:
[O-]S(=O)(=O)C(F)(F)F.CCOC(=O)c1ccc(cc1)[N+](C)(C)C
Properties
Complexity:
357  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.086g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
357.344g/mol
Monoisotopic Mass:
357.086g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties