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DTT-2,6-dicarboxylic acid

Catalog Number
ACM502764536-3
Product Name
DTT-2,6-dicarboxylic acid
CAS
502764-53-6
Category
Customizable MOF Linkers
Synonyms
H2DTDC
IUPAC Name
3,7,11-trithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene-4,10-dicarboxylic acid
Molecular Weight
284.33
Molecular Formula
C10H4O4S3
InChI
InChI=1S/C10H4O4S3/c11-9(12)5-1-3-7(16-5)8-4(15-3)2-6(17-8)10(13)14/h1-2H,(H,11,12)(H,13,14)
InChI Key
XQMFYBSHBCPMBJ-UHFFFAOYSA-N
Purity
96%
Appearance
Yellowish solid
Complexity
341
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
283.92717213g/mol
Formal Charge
0
Heavy Atom Count
17
Hydrogen Bond Acceptor Count
7
Hydrogen Bond Donor Count
2
Isotope Atom Count
0
Monoisotopic Mass
283.92717213g/mol
Rotatable Bond Count
2
Topological Polar Surface Area
159Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
3.5
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