3,5-Pyridinedicarboxylic acid, diisopropyl ester

dipropan-2-yl pyridine-3,5-dicarboxylate

CAS: 3737-22-2

Molecular Formula	`C13H17NO4`
Molecular Weight	251.28 g/mol
LogP	2.2
Topological Polar Surface Area	65.5 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	251.11575
Heavy Atoms	18
Complexity	273.0

Chemical Identifiers

CAS Number	3737-22-2
SMILES	`CC(C)OC(=O)C1=CC(=CN=C1)C(=O)OC(C)C`
InChIKey	`JHKOMVRNWGLUFA-UHFFFAOYSA-N`

📖 Product Overview

3,5-Pyridinedicarboxylic acid, diisopropyl ester (CAS: 3737-22-2) is a chemical compound with molecular formula C13H17NO4 and molecular weight 251.28 g/mol. Its IUPAC systematic name is dipropan-2-yl pyridine-3,5-dicarboxylate. LogP 2.2 Topological Polar Surface Area 65.5 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 6 Exact Mass 251.11575 Heavy Atoms 18 Complexity 273.0 InChI Key: JHKOMVRNWGLUFA-UHFFFAOYSA-N. SMILES: CC(C)OC(=O)C1=CC(=CN=C1)C(=O)OC(C)C.

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