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1,2-Benzenedicarboxylicacid, 4,4'-oxybis-

Catalog Number
ACM7717762-2
CAS Number
7717-76-2
Product Name
1,2-Benzenedicarboxylicacid, 4,4'-oxybis-
Structure
Category
Carboxylic acid MOF ligand-tetracarboxylic acid MOF ligand
Synonyms
4,4'-Oxybis-1,2-benzenedicarboxylic acid
IUPAC Name
4-(3,4-dicarboxyphenoxy)phthalic acid
Molecular Weight
346.25
Molecular Formula
C16H10O9
InChI
InChI=1S/C16H10O9/c17-13(18)9-3-1-7(5-11(9)15(21)22)25-8-2-4-10(14(19)20)12(6-8)16(23)24/h1-6H,(H,17,18)(H,19,20)(H,21,22)(H,23,24)
InChI Key
AIVVXPSKEVWKMY-UHFFFAOYSA-N
Purity
97%
Complexity
510
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
346.03248189g/mol
Formal Charge
0
Heavy Atom Count
25
Hydrogen Bond Acceptor Count
9
Hydrogen Bond Donor Count
4
Isotope Atom Count
0
Monoisotopic Mass
346.03248189g/mol
Rotatable Bond Count
6
Topological Polar Surface Area
158Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
1.6
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