Home Sulfos methyl 3-fluorobenzene-1-sulfonate

methyl 3-fluorobenzene-1-sulfonate

CAS No.:
1865148-58-8
Catalog Number:
AG01C8Z5
Molecular Formula:
C7H7FO3S
Molecular Weight:
190.1921
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Product Description
Catalog Number:
AG01C8Z5
Chemical Name:
methyl 3-fluorobenzene-1-sulfonate
CAS Number:
1865148-58-8
Molecular Formula:
C7H7FO3S
Molecular Weight:
190.1921
MDL Number:
MFCD31443750
IUPAC Name:
methyl 3-fluorobenzenesulfonate
InChI:
InChI=1S/C7H7FO3S/c1-11-12(9,10)7-4-2-3-6(8)5-7/h2-5H,1H3
InChI Key:
KLINELVCVRRAJI-UHFFFAOYSA-N
SMILES:
COS(=O)(=O)c1cccc(c1)F
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.01g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.188g/mol
Monoisotopic Mass:
190.01g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties