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1094026-90-0 | 2-Iodobenzenesulfonic Acid Dihydrate
CAS No: 1094026-90-0 Catalog No: AG003HGR MDL No:
Product Description
Catalog Number:
AG003HGR
Chemical Name:
2-Iodobenzenesulfonic Acid Dihydrate
CAS Number:
1094026-90-0
IUPAC Name:
2-iodobenzenesulfonic acid;dihydrate
InChI:
InChI=1S/C6H5IO3S.2H2O/c7-5-3-1-2-4-6(5)11(8,9)10;;/h1-4H,(H,8,9,10);2*1H2
InChI Key:
KTRRNQJQOURTCC-UHFFFAOYSA-N
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.922g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
320.097g/mol
Monoisotopic Mass:
319.922g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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