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162193-52-4 | 2-DeiodoAmidotrizoicAcid
CAS No: 162193-52-4 Catalog No: AG01E2J0 MDL No:
Product Description
Catalog Number:
AG01E2J0
Chemical Name:
2-DeiodoAmidotrizoicAcid
CAS Number:
162193-52-4
IUPAC Name:
3,5-diacetamido-2,4-diiodobenzoic acid
InChI:
InChI=1S/C11H10I2N2O4/c1-4(16)14-7-3-6(11(18)19)8(12)10(9(7)13)15-5(2)17/h3H,1-2H3,(H,14,16)(H,15,17)(H,18,19)
InChI Key:
IUTSOSUQGPWYBZ-UHFFFAOYSA-N
UNII:
7D91L944D9
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
487.873g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
488.02g/mol
Monoisotopic Mass:
487.873g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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