Home Sulfos methyl 2-fluoro-4-(fluorosulfonyl)benzoate

methyl 2-fluoro-4-(fluorosulfonyl)benzoate

CAS No.:
1909313-75-2
Catalog Number:
AG01AMHE
Molecular Formula:
C8H6F2O4S
Molecular Weight:
236.1926
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Product Description
Catalog Number:
AG01AMHE
Chemical Name:
methyl 2-fluoro-4-(fluorosulfonyl)benzoate
CAS Number:
1909313-75-2
Molecular Formula:
C8H6F2O4S
Molecular Weight:
236.1926
MDL Number:
MFCD28968553
IUPAC Name:
methyl 2-fluoro-4-fluorosulfonylbenzoate
InChI:
InChI=1S/C8H6F2O4S/c1-14-8(11)6-3-2-5(4-7(6)9)15(10,12)13/h2-4H,1H3
InChI Key:
MVZNEFRVGUWAFO-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1F)S(=O)(=O)F
Properties
Complexity:
335  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.995g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.189g/mol
Monoisotopic Mass:
235.995g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties