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17763-65-4 | Methanesulfonic acid, 1,1,1-trifluoro-, [1,1'-biphenyl]-2-yl ester
CAS No: 17763-65-4 Catalog No: AG0025FS MDL No:
Product Description
Catalog Number:
AG0025FS
Chemical Name:
Methanesulfonic acid, 1,1,1-trifluoro-, [1,1'-biphenyl]-2-yl ester
CAS Number:
17763-65-4
Molecular Formula:
C13H9F3O3S
Molecular Weight:
302.2690
IUPAC Name:
(2-phenylphenyl) trifluoromethanesulfonate
InChI:
InChI=1S/C13H9F3O3S/c14-13(15,16)20(17,18)19-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H
InChI Key:
RKXHGAAXTVZDNE-UHFFFAOYSA-N
SMILES:
O=S(=O)(C(F)(F)F)Oc1ccccc1c1ccccc1
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.022g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.267g/mol
Monoisotopic Mass:
302.022g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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