Home Sulfos Benzoic acid,3-(fluorosulfonyl)-4-methyl-

Benzoic acid,3-(fluorosulfonyl)-4-methyl-

CAS No.:
21322-93-0
Catalog Number:
AG01AMLI
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01AMLI
Chemical Name:
Benzoic acid,3-(fluorosulfonyl)-4-methyl-
CAS Number:
21322-93-0
MDL Number:
MFCD06208275
IUPAC Name:
3-fluorosulfonyl-4-methylbenzoic acid
InChI:
InChI=1S/C8H7FO4S/c1-5-2-3-6(8(10)11)4-7(5)14(9,12)13/h2-4H,1H3,(H,10,11)
InChI Key:
BANDUEHUKCIKIF-UHFFFAOYSA-N
NSC Number:
184697
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.005g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.198g/mol
Monoisotopic Mass:
218.005g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties