Home Other Building Blocks 100431-21-8
100431-21-8,MFCD11707198
Catalog No.:AA0001X0
100431-21-8 | (R)-Mesityl phenyl sulfoxide
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
1 week  
$296.00   $207.00
- +
5g
97%
1 week  
$975.00   $683.00
- +
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Technical Information
Catalog Number:
AA0001X0
Chemical Name:
(R)-Mesityl phenyl sulfoxide
CAS Number:
100431-21-8
Molecular Formula:
C15H16OS
Molecular Weight:
244.3519
MDL Number:
MFCD11707198
IUPAC Name:
1,3,5-trimethyl-2-[(R)-phenylsulfinyl]benzene
InChI:
InChI=1S/C15H16OS/c1-11-9-12(2)15(13(3)10-11)17(16)14-7-5-4-6-8-14/h4-10H,1-3H3/t17-/m1/s1
InChI Key:
NPTGGTKSCLGSSS-QGZVFWFLSA-N
SMILES:
Cc1cc(C)c(c(c1)C)[S@](=O)c1ccccc1
Properties
Computed Properties
 
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
244.092g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.352g/mol
Monoisotopic Mass:
244.092g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

Synonyms
 
(R)-MESITYL PHENYL SULFOXIDE 
(R)-1,3,5-Trimethyl-2-(phenylsulfinyl)benzene 
100431-21-8 
MFCD11707198 
ZINC44139398 
AS-43867 
AX8267107 
X-3007 
Literature
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