MALONIC ACID, DIETHYL-, ETHYL ISOBUTYL ESTER

1-O-butan-2-yl 3-O-ethyl 2,2-diethylpropanedioate

CAS: 63917-09-9

Molecular Formula	`C13H24O4`
Molecular Weight	244.33 g/mol
LogP	3.5
Topological Polar Surface Area	52.6 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	9
Exact Mass	244.16747
Heavy Atoms	17
Complexity	256.0

Chemical Identifiers

CAS Number	63917-09-9
SMILES	`CCC(C)OC(=O)C(CC)(CC)C(=O)OCC`
InChIKey	`KIXXIXABYBOQEB-UHFFFAOYSA-N`

📖 Product Overview

MALONIC ACID, DIETHYL-, ETHYL ISOBUTYL ESTER (CAS: 63917-09-9) is a chemical compound with molecular formula C13H24O4 and molecular weight 244.33 g/mol. Its IUPAC systematic name is 1-O-butan-2-yl 3-O-ethyl 2,2-diethylpropanedioate. LogP 3.5 Topological Polar Surface Area 52.6 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 9 Exact Mass 244.16747 Heavy Atoms 17 Complexity 256.0 InChI Key: KIXXIXABYBOQEB-UHFFFAOYSA-N. SMILES: CCC(C)OC(=O)C(CC)(CC)C(=O)OCC.

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