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2-Iodoterephthalic acid

Catalog Number
ACM1829227-1
CAS Number
1829-22-7
Product Name
2-Iodoterephthalic acid
Structure
Category
Carboxylic acid MOF ligand-dicarboxylic acid MOF ligand
Synonyms
BDC-I
IUPAC Name
2-iodoterephthalic acid
Molecular Weight
292.03
Molecular Formula
C8H5O4I
InChI
InChI=1S/C8H5IO4/c9-6-3-4(7(10)11)1-2-5(6)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChI Key
LUZKKRPROWYBLR-UHFFFAOYSA-N
Purity
98%
Appearance
Off-white solid
Complexity
228
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
291.92326g/mol
Formal Charge
0
Heavy Atom Count
13
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
2
Isotope Atom Count
0
Monoisotopic Mass
291.92326g/mol
Rotatable Bond Count
2
Topological Polar Surface Area
74.6Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
1.6
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