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21205-05-0,MFCD11545096
Catalog No.:AA003I68
21205-05-0 | (3-Methanesulfonylphenyl)(phenyl)methanone
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1g
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$183.00   $128.00
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Technical Information
Catalog Number:
AA003I68
Chemical Name:
(3-Methanesulfonylphenyl)(phenyl)methanone
CAS Number:
21205-05-0
Molecular Formula:
C14H12O3S
Molecular Weight:
260.3083
MDL Number:
MFCD11545096
IUPAC Name:
(3-methylsulfonylphenyl)-phenylmethanone
InChI:
InChI=1S/C14H12O3S/c1-18(16,17)13-9-5-8-12(10-13)14(15)11-6-3-2-4-7-11/h2-10H,1H3
InChI Key:
OMFWZKUKFTYSPC-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)S(=O)(=O)C)c1ccccc1
Properties
Computed Properties
 
Complexity:
388  
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:
2.6  

Synonyms
 
3-(Methylsulfonyl)benzophenone 
21205-05-0 
MCULE-1635034836 
TRA0069061 
AS-32586 
SY020370 
TC-307279 
EN300-90260 
Z-4580 
MFCD11545096 (95+%) 
Z1262398569 
C14H12O3S 
(3-methanesulfonylphenyl)(phenyl)methanone 
313490-36-7 
3-methylsulphonylbenzophenone 
CTK8E1771 
KS-00000C4Z 
5722AJ 
MFCD11545096 
ZINC37357879 
AKOS009338878 
Literature
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