Home Sulfos benzyl 2-methanesulfonylacetate

benzyl 2-methanesulfonylacetate

CAS No.:
175465-93-7
Catalog Number:
AG01BBGU
Molecular Formula:
C10H12O4S
Molecular Weight:
228.2649
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Product Description
Catalog Number:
AG01BBGU
Chemical Name:
benzyl 2-methanesulfonylacetate
CAS Number:
175465-93-7
Molecular Formula:
C10H12O4S
Molecular Weight:
228.2649
MDL Number:
MFCD25958774
IUPAC Name:
benzyl 2-methylsulfonylacetate
InChI:
InChI=1S/C10H12O4S/c1-15(12,13)8-10(11)14-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3
InChI Key:
CBJZWSNCLNIXKD-UHFFFAOYSA-N
SMILES:
O=C(CS(=O)(=O)C)OCc1ccccc1
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.046g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.262g/mol
Monoisotopic Mass:
228.046g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties