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Structure

[2,2':6',2''-Terpyridine]-4'-carboxylic acid

CAS
148332-36-9
Catalog Number
ACM148332369-1
Category
Promotional Products
Molecular Weight
277.28
Molecular Formula
C16H11N3O2

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Specification

Synonyms
4'-Carboxyl-2,2':6',2''-terpyridine
IUPAC Name
2,6-dipyridin-2-ylpyridine-4-carboxylic acid;
Canonical SMILES
C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C(=O)O;
InChI
InChI=1S/C16H11N3O2/c20-16(21)11-9-14(12-5-1-3-7-17-12)19-15(10-11)13-6-2-4-8-18-13/h1-10H,(H,20,21);
InChI Key
ZYTWXMBGOUJDHJ-UHFFFAOYSA-N;
Appearance
solid
Complexity
337
Covalently-Bonded Unit Count
1
Exact Mass
277.085g/mol
H-Bond Acceptor
5
H-Bond Donor
1
Heavy Atom Count
21
Monoisotopic Mass
277.085g/mol
Rotatable Bond Count
3
Topological Polar Surface Area
76A^2
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