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

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

CAS: 69641-93-6

Formula: C20H24N2O4

SMILES: CCCCOC(=O)C1=CC(=NC=C1)C1=NC=CC(=C1)C(=O)OCCCC

IUPAC: 4,4'-dibutyl [2,2'-bipyridine]-4,4'-dicarboxylate

InChI: InChI=1S/C20H24N2O4/c1-3-5-11-25-19(23)15-7-9-21-17(13-15)18-14-16(8-10-22-18)20(24)26-12-6-4-2/h7-10,13-14H,3-6,11-12H2,1-2H3

Composition: C (67.40%), H (6.79%), N (7.86%), O (17.96%)

Molar Mass: 356.422

Atom Count: 50

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	356.173607261
Formal Charge	0
FSP3	0.4
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	XJRBANJUKBOCLR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	97.93
Topological Polar Surface Area	78.38
Polarizability	39.38
Ring Count	2
Rotatable Bond Count	11

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