NAVIGATION


[1, 1':3', 1''- Terphenyl] - 4, 4''- dicarboxylic acid, 5'- bromo-

Catalog NumberACM1250980109

CAS Number1250980-10-9

CategoryCustomizable MOF Linkers

Synonyms
5'-Bromo-[1,1':3',1''-terphenyl]-4,4''-dicarboxylic acid
IUPAC Name
4-[3-bromo-5-(4-carboxyphenyl)phenyl]benzoic acid
Molecular Weight
397.2g/mol
Molecular Formula
C20H13BrO4
InChI
InChI=1S/C20H13BrO4/c21-18-10-16(12-1-5-14(6-2-12)19(22)23)9-17(11-18)13-3-7-15(8-4-13)20(24)25/h1-11H,(H,22,23)(H,24,25)
InChI Key
SJPCRNBUFAEKHO-UHFFFAOYSA-N
Purity
99%
Complexity
436
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
395.99972g/mol
Formal Charge
0
Heavy Atom Count
25
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
2
Isotope Atom Count
0
Monoisotopic Mass
395.99972g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
74.6Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
4.9
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