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65085-83-8 | 1-(4-(Phenylsulfonyl)phenyl)ethanone
CAS No: 65085-83-8 Catalog No: AG003KMW MDL No:MFCD00173085
Product Description
Catalog Number:
AG003KMW
Chemical Name:
1-(4-(Phenylsulfonyl)phenyl)ethanone
CAS Number:
65085-83-8
Molecular Formula:
C14H12O3S
Molecular Weight:
260.3083
MDL Number:
MFCD00173085
IUPAC Name:
1-[4-(benzenesulfonyl)phenyl]ethanone
InChI:
InChI=1S/C14H12O3S/c1-11(15)12-7-9-14(10-8-12)18(16,17)13-5-3-2-4-6-13/h2-10H,1H3
InChI Key:
FGFHDNIGKVTTLC-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(cc1)S(=O)(=O)c1ccccc1
NSC Number:
102493
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.051g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.307g/mol
Monoisotopic Mass:
260.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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