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921765-49-3

921765-49-3 | Ethanone, 1-[4-[(4-methylphenyl)sulfinyl]phenyl]-

CAS No: 921765-49-3 Catalog No: AG006GP6 MDL No:

Product Description

Catalog Number:
AG006GP6
Chemical Name:
Ethanone, 1-[4-[(4-methylphenyl)sulfinyl]phenyl]-
CAS Number:
921765-49-3
Molecular Formula:
C15H14O2S
Molecular Weight:
258.3355
IUPAC Name:
1-[4-(4-methylphenyl)sulfinylphenyl]ethanone
InChI:
InChI=1S/C15H14O2S/c1-11-3-7-14(8-4-11)18(17)15-9-5-13(6-10-15)12(2)16/h3-10H,1-2H3
InChI Key:
UQFMGLZPLSCMCR-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)c1ccc(cc1)C(=O)C

Properties

Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.071g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.335g/mol
Monoisotopic Mass:
258.071g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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