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131-62-4 | 1,2-Benziodoxol-3(1H)-one, 1-hydroxy-
CAS No: 131-62-4 Catalog No: AG000VBD MDL No:MFCD01658875
Product Description
Catalog Number:
AG000VBD
Chemical Name:
1,2-Benziodoxol-3(1H)-one, 1-hydroxy-
CAS Number:
131-62-4
Molecular Formula:
C7H5IO3
Molecular Weight:
264.0173
MDL Number:
MFCD01658875
IUPAC Name:
1-hydroxy-1λ3,2-benziodoxol-3-one
InChI:
InChI=1S/C7H5IO3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h1-4,10H
InChI Key:
AZJIXRYFAZOEMC-UHFFFAOYSA-N
SMILES:
O=C1O[I](c2c1cccc2)O
NSC Number:
364374
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.928g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.018g/mol
Monoisotopic Mass:
263.928g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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