Home Sulfos pentafluorophenyl 4-methyl-1,3-thiazole-2-sulfonate

pentafluorophenyl 4-methyl-1,3-thiazole-2-sulfonate

CAS No.:
1421602-12-1
Catalog Number:
AG019Z2S
Molecular Formula:
C10H4F5NO3S2
Molecular Weight:
345.2657
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Product Description
Catalog Number:
AG019Z2S
Chemical Name:
pentafluorophenyl 4-methyl-1,3-thiazole-2-sulfonate
CAS Number:
1421602-12-1
Molecular Formula:
C10H4F5NO3S2
Molecular Weight:
345.2657
MDL Number:
MFCD22391917
IUPAC Name:
(2,3,4,5,6-pentafluorophenyl) 4-methyl-1,3-thiazole-2-sulfonate
InChI:
InChI=1S/C10H4F5NO3S2/c1-3-2-20-10(16-3)21(17,18)19-9-7(14)5(12)4(11)6(13)8(9)15/h2H,1H3
InChI Key:
AEVLNSYJKMQNMI-UHFFFAOYSA-N
SMILES:
Cc1csc(n1)S(=O)(=O)Oc1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
460  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.955g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
345.258g/mol
Monoisotopic Mass:
344.955g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties