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138219-56-4 | Benzenesulfonyl fluoride, 4-[5-[4-(dimethylamino)phenyl]-2-oxazolyl]-
CAS No: 138219-56-4 Catalog No: AG0018BQ MDL No:
Product Description
Catalog Number:
AG0018BQ
Chemical Name:
Benzenesulfonyl fluoride, 4-[5-[4-(dimethylamino)phenyl]-2-oxazolyl]-
CAS Number:
138219-56-4
Molecular Formula:
C17H15FN2O3S
Molecular Weight:
346.3760
IUPAC Name:
4-[5-[4-(dimethylamino)phenyl]-1,3-oxazol-2-yl]benzenesulfonyl fluoride
InChI:
InChI=1S/C17H15FN2O3S/c1-20(2)14-7-3-12(4-8-14)16-11-19-17(23-16)13-5-9-15(10-6-13)24(18,21)22/h3-11H,1-2H3
InChI Key:
VWMNBJGUUAOGCO-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1)c1cnc(o1)c1ccc(cc1)S(=O)(=O)F)C
Properties
Complexity:
506
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.079g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.376g/mol
Monoisotopic Mass:
346.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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