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89011-02-9 | Benzamide, N-(1,1-dimethylethyl)-2-hydroxy-3,5-diiodo-
CAS No: 89011-02-9 Catalog No: AG0043K3 MDL No:
Product Description
Catalog Number:
AG0043K3
Chemical Name:
Benzamide, N-(1,1-dimethylethyl)-2-hydroxy-3,5-diiodo-
CAS Number:
89011-02-9
Molecular Formula:
C11H13I2NO2
Molecular Weight:
445.0354
IUPAC Name:
N-tert-butyl-2-hydroxy-3,5-diiodobenzamide
InChI:
InChI=1S/C11H13I2NO2/c1-11(2,3)14-10(16)7-4-6(12)5-8(13)9(7)15/h4-5,15H,1-3H3,(H,14,16)
InChI Key:
VNHDFMDJSDJTRG-UHFFFAOYSA-N
SMILES:
Ic1cc(I)c(c(c1)C(=O)NC(C)(C)C)O
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
444.904g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
445.039g/mol
Monoisotopic Mass:
444.904g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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