n-Butylisopropylbarbituric acid

5-butyl-5-propan-2-yl-1,3-diazinane-2,4,6-trione

CAS: 53943-63-8

Molecular Formula	`C11H18N2O3`
Molecular Weight	226.27 g/mol
LogP	2.1
Topological Polar Surface Area	75.3 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	4
Exact Mass	226.13174
Heavy Atoms	16
Complexity	303.0

Chemical Identifiers

CAS Number	53943-63-8
SMILES	`CCCCC1(C(=O)NC(=O)NC1=O)C(C)C`
InChIKey	`TZEHVHWISALEFS-UHFFFAOYSA-N`

📖 Product Overview

n-Butylisopropylbarbituric acid (CAS: 53943-63-8) is a chemical compound with molecular formula C11H18N2O3 and molecular weight 226.27 g/mol. Its IUPAC systematic name is 5-butyl-5-propan-2-yl-1,3-diazinane-2,4,6-trione. LogP 2.1 Topological Polar Surface Area 75.3 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 4 Exact Mass 226.13174 Heavy Atoms 16 Complexity 303.0 InChI Key: TZEHVHWISALEFS-UHFFFAOYSA-N. SMILES: CCCCC1(C(=O)NC(=O)NC1=O)C(C)C.

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