200,000+ products from a single source!
sales@angenechem.com
88621-58-3 | 1,2-Benzisothiazole, 3-(pentafluorophenoxy)-, 1,1-dioxide
CAS No: 88621-58-3 Catalog No: AG004C93 MDL No:
Product Description
Catalog Number:
AG004C93
Chemical Name:
1,2-Benzisothiazole, 3-(pentafluorophenoxy)-, 1,1-dioxide
CAS Number:
88621-58-3
Molecular Formula:
C13H4F5NO3S
Molecular Weight:
349.2328
IUPAC Name:
3-(2,3,4,5,6-pentafluorophenoxy)-1,2-benzothiazole 1,1-dioxide
InChI:
InChI=1S/C13H4F5NO3S/c14-7-8(15)10(17)12(11(18)9(7)16)22-13-5-3-1-2-4-6(5)23(20,21)19-13/h1-4H
InChI Key:
YDBTZOOFIPGGBL-UHFFFAOYSA-N
SMILES:
Fc1c(OC2=NS(=O)(=O)c3c2cccc3)c(F)c(c(c1F)F)F
Properties
Complexity:
579
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.983g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
349.231g/mol
Monoisotopic Mass:
348.983g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.