Home Sulfos methyl 5-(chlorosulfonyl)-2-fluoro-4-methoxybenzoate

methyl 5-(chlorosulfonyl)-2-fluoro-4-methoxybenzoate

CAS No.:
2060056-99-5
Catalog Number:
AG01BUYK
Molecular Formula:
C9H8ClFO5S
Molecular Weight:
282.6732
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Product Description
Catalog Number:
AG01BUYK
Chemical Name:
methyl 5-(chlorosulfonyl)-2-fluoro-4-methoxybenzoate
CAS Number:
2060056-99-5
Molecular Formula:
C9H8ClFO5S
Molecular Weight:
282.6732
MDL Number:
MFCD30497568
IUPAC Name:
methyl 5-chlorosulfonyl-2-fluoro-4-methoxybenzoate
InChI:
InChI=1S/C9H8ClFO5S/c1-15-7-4-6(11)5(9(12)16-2)3-8(7)17(10,13)14/h3-4H,1-2H3
InChI Key:
AATHIWGAMVPUCT-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(c(cc1F)OC)S(=O)(=O)Cl
Properties
Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.977g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.666g/mol
Monoisotopic Mass:
281.977g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties