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71463-71-3 | Benzoic acid,2,3,4,6-tetraiodo-
CAS No: 71463-71-3 Catalog No: AG0066TL MDL No:MFCD30609467
Product Description
Catalog Number:
AG0066TL
Chemical Name:
Benzoic acid,2,3,4,6-tetraiodo-
CAS Number:
71463-71-3
Molecular Formula:
C7H2I4O2
Molecular Weight:
625.7075
MDL Number:
MFCD30609467
IUPAC Name:
2,3,4,6-tetraiodobenzoic acid
InChI:
InChI=1S/C7H2I4O2/c8-2-1-3(9)5(10)6(11)4(2)7(12)13/h1H,(H,12,13)
InChI Key:
BAUFQNBASVMUOB-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(I)cc(c(c1I)I)I
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
625.623g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
625.709g/mol
Monoisotopic Mass:
625.623g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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