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2,5-Dimercaptoterephthalic acid

Catalog Number
ACM25906665
Product Name
2,5-Dimercaptoterephthalic acid
Structure
CAS
25906-66-5
Category
Carboxylic acid MOF ligand-dicarboxylic acid MOF ligand
Synonyms
2,5-Disulfhydrylbenzene-1,4-dicarboxylic acid
IUPAC Name
2,5-bis(sulfanyl)terephthalic acid
Molecular Weight
230.26
Molecular Formula
C8H6O4S2
InChI
InChI=1S/C8H6O4S2/c9-7(10)3-1-5(13)4(8(11)12)2-6(3)14/h1-2,13-14H,(H,9,10)(H,11,12)
InChI Key
YYGZWQNDFRCZIF-UHFFFAOYSA-N
Purity
97%
Appearance
Light yellow powder
Complexity
230
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
EC Number
247-330-3
Exact Mass
229.97075102g/mol
Formal Charge
0
Heavy Atom Count
14
Hydrogen Bond Acceptor Count
6
Hydrogen Bond Donor Count
4
Isotope Atom Count
0
Monoisotopic Mass
229.97075102g/mol
Rotatable Bond Count
2
Topological Polar Surface Area
76.6Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
1.3
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