NAVIGATION


5, 5'- (9, 10- anthracenediyldi- 2, 1- ethynediyl) bis-isophthalic acid

Catalog NumberACM1337923871

CAS Number1337923-87-1

CategoryCustomizable MOF Linkers

IUPAC Name
5-[2-[10-[2-(3,5-dicarboxyphenyl)ethynyl]anthracen-9-yl]ethynyl]benzene-1,3-dicarboxylic acid
Molecular Weight
554.5
Molecular Formula
C34H18O8
InChI
InChI=1S/C34H18O8/c35-31(36)21-13-19(14-22(17-21)32(37)38)9-11-29-25-5-1-2-6-26(25)30(28-8-4-3-7-27(28)29)12-10-20-15-23(33(39)40)18-24(16-20)34(41)42/h1-8,13-18H,(H,35,36)(H,37,38)(H,39,40)(H,41,42)
InChI Key
SRAGFZDNJDDTLM-UHFFFAOYSA-N
Purity
98%
Complexity
1050
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
554.10016753g/mol
Formal Charge
0
Heavy Atom Count
42
Hydrogen Bond Acceptor Count
8
Hydrogen Bond Donor Count
4
Isotope Atom Count
0
Monoisotopic Mass
554.10016753g/mol
Rotatable Bond Count
8
Topological Polar Surface Area
149Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
6.6
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