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31075-53-3 | Benzenemethanol, 2,3,5-triiodo-
CAS No: 31075-53-3 Catalog No: AG00321T MDL No:
Product Description
Catalog Number:
AG00321T
Chemical Name:
Benzenemethanol, 2,3,5-triiodo-
CAS Number:
31075-53-3
Molecular Formula:
C7H5I3O
Molecular Weight:
485.8274
IUPAC Name:
(2,3,5-triiodophenyl)methanol
InChI:
InChI=1S/C7H5I3O/c8-5-1-4(3-11)7(10)6(9)2-5/h1-2,11H,3H2
InChI Key:
KFZNKUWVRXKLJP-UHFFFAOYSA-N
SMILES:
OCc1cc(I)cc(c1I)I
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
485.747g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
485.829g/mol
Monoisotopic Mass:
485.747g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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