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88419-63-0 | Fluorosulfuric acid, 2,4,6-trimethylphenyl ester
CAS No: 88419-63-0 Catalog No: AG004EWG MDL No:
Product Description
Catalog Number:
AG004EWG
Chemical Name:
Fluorosulfuric acid, 2,4,6-trimethylphenyl ester
CAS Number:
88419-63-0
Molecular Formula:
C9H11FO3S
Molecular Weight:
218.2452
IUPAC Name:
2-fluorosulfonyloxy-1,3,5-trimethylbenzene
InChI:
InChI=1S/C9H11FO3S/c1-6-4-7(2)9(8(3)5-6)13-14(10,11)12/h4-5H,1-3H3
InChI Key:
IEBGVSHNNLZDEH-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)C)OS(=O)(=O)F
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.041g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.242g/mol
Monoisotopic Mass:
218.041g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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