200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 139278-62-9
139278-62-9 | Benzoic acid, 2,5-bis[[(trifluoromethyl)sulfonyl]oxy]-, methyl ester
CAS No: 139278-62-9 Catalog No: AG001ANQ MDL No:
Product Description
Catalog Number:
AG001ANQ
Chemical Name:
Benzoic acid, 2,5-bis[[(trifluoromethyl)sulfonyl]oxy]-, methyl ester
CAS Number:
139278-62-9
Molecular Formula:
C10H6F6O8S2
Molecular Weight:
432.2703
IUPAC Name:
methyl 2,5-bis(trifluoromethylsulfonyloxy)benzoate
InChI:
InChI=1S/C10H6F6O8S2/c1-22-8(17)6-4-5(23-25(18,19)9(11,12)13)2-3-7(6)24-26(20,21)10(14,15)16/h2-4H,1H3
InChI Key:
SYVOHSVHIYKCNW-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(ccc1OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F
Properties
Complexity:
715
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
431.941g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
14
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
432.26g/mol
Monoisotopic Mass:
431.941g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.