Home Sulfos Methyl 2-(3-chlorophenyl)sulfonylacetate

Methyl 2-(3-chlorophenyl)sulfonylacetate

CAS No.:
78066-30-5
Catalog Number:
AG01FC51
Molecular Formula:
C9H9ClO4S
Molecular Weight:
248.6834
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$441
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Product Description
Catalog Number:
AG01FC51
Chemical Name:
Methyl 2-(3-chlorophenyl)sulfonylacetate
CAS Number:
78066-30-5
Molecular Formula:
C9H9ClO4S
Molecular Weight:
248.6834
MDL Number:
MFCD16835708
IUPAC Name:
methyl 2-(3-chlorophenyl)sulfonylacetate
InChI:
InChI=1S/C9H9ClO4S/c1-14-9(11)6-15(12,13)8-4-2-3-7(10)5-8/h2-5H,6H2,1H3
InChI Key:
UUIGWLTXNSCYIF-UHFFFAOYSA-N
SMILES:
COC(=O)CS(=O)(=O)c1cccc(c1)Cl
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.991g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.677g/mol
Monoisotopic Mass:
247.991g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties