Home Sulfos pentafluorophenyl 5-chloropyrimidine-2-sulfonate

pentafluorophenyl 5-chloropyrimidine-2-sulfonate

CAS No.:
1803604-84-3
Catalog Number:
AG01BCTG
Molecular Formula:
C10H2ClF5N2O3S
Molecular Weight:
360.6445
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Product Description
Catalog Number:
AG01BCTG
Chemical Name:
pentafluorophenyl 5-chloropyrimidine-2-sulfonate
CAS Number:
1803604-84-3
Molecular Formula:
C10H2ClF5N2O3S
Molecular Weight:
360.6445
MDL Number:
MFCD28139359
IUPAC Name:
(2,3,4,5,6-pentafluorophenyl) 5-chloropyrimidine-2-sulfonate
InChI:
InChI=1S/C10H2ClF5N2O3S/c11-3-1-17-10(18-2-3)22(19,20)21-9-7(15)5(13)4(12)6(14)8(9)16/h1-2H
InChI Key:
RKRJQLQPDOQCGN-UHFFFAOYSA-N
SMILES:
Clc1cnc(nc1)S(=O)(=O)Oc1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
471  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
359.939g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
360.639g/mol
Monoisotopic Mass:
359.939g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
77.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties