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Diethyl 2,2':6',2''-Terpyridine-4'-phosphonate

Catalog Number
ACM161583751-2
CAS Number
161583-75-1
Product Name
Diethyl 2,2':6',2''-Terpyridine-4'-phosphonate
Structure
Category
Ligands for Functional Metal Complexes
Synonyms
2,2':6',2''-Terpyridine-4'-phosphonic Acid Diethyl Ester
IUPAC Name
4-diethoxyphosphoryl-2,6-dipyridin-2-ylpyridine;
Molecular Weight
369.35
Molecular Formula
C19H20N3O3P
Canonical SMILES
CCOP(=O)(C1=CC(=NC(=C1)C2=CC=CC=N2)C3=CC=CC=N3)OCC;
InChI
InChI=1S/C19H20N3O3P/c1-3-24-26(23,25-4-2)15-13-18(16-9-5-7-11-20-16)22-19(14-15)17-10-6-8-12-21-17/h5-14H,3-4H2,1-2H3;
InChI Key
MDIMWBGOUZAXEP-UHFFFAOYSA-N;
Purity
93%+
Appearance
Powder or crystal
Complexity
443
Covalently-Bonded Unit Count
1
Exact Mass
369.124g/mol
Heavy Atom Count
26
Monoisotopic Mass
369.124g/mol
Rotatable Bond Count
7
Topological Polar Surface Area
74.2A^2
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