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Structure

Dimethyl [2,2'-bipyridine]-4,4'-dicarboxylate

CAS
71071-46-0
Catalog Number
ACM71071460-2
Category
Other Products
Molecular Weight
272.26
Molecular Formula
C14H12N2O4

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Specification

Synonyms
4,4'-bis(methoxycarbonly)-2,2'-bipyridine; 2,2'-Bipyridinyl-4,4'-dicarboxylic acid dimethyl ester
IUPAC Name
methyl 2-(4-methoxycarbonylpyridin-2-yl)pyridine-4-carboxylate;
Canonical SMILES
COC(=O)C1=CC(=NC=C1)C2=NC=CC(=C2)C(=O)OC;
InChI
InChI=1S/C14H12N2O4/c1-19-13(17)9-3-5-15-11(7-9)12-8-10(4-6-16-12)14(18)20-2/h3-8H,1-2H3;
InChI Key
HBWBVIDKBKOVEX-UHFFFAOYSA-N;
Boiling Point
208-212 °C
Melting Point
208-212 °C
Appearance
Off-white powder
Complexity
327
Covalently-Bonded Unit Count
1
Exact Mass
272.08g/mol
H-Bond Acceptor
6
Heavy Atom Count
20
Monoisotopic Mass
272.08g/mol
NSC Number
297840
Rotatable Bond Count
5
Topological Polar Surface Area
78.4A^2
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