Butamirate citrate structure

Butamirate citrate

2-[2-(diethylamino)ethoxy]ethyl 2-phenylbutanoate;2-hydroxypropane-1,2,3-tricarboxylic acid

CAS: 18109-81-4
Molecular Formula C24H37NO10
Molecular Weight 499.6 g/mol
Topological Polar Surface Area 171.0 A2
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 11
Rotatable Bonds 17
Exact Mass 499.24176
Heavy Atoms 35
Complexity 513.0

Chemical Identifiers

CAS Number 18109-81-4
SMILES CCC(C1=CC=CC=C1)C(=O)OCCOCCN(CC)CC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
InChIKey JVKMHUAWFDGPTF-UHFFFAOYSA-N

📖 Product Overview

Butamirate citrate (CAS: 18109-81-4) is a chemical compound with molecular formula C24H37NO10 and molecular weight 499.6 g/mol. Its IUPAC systematic name is 2-[2-(diethylamino)ethoxy]ethyl 2-phenylbutanoate;2-hydroxypropane-1,2,3-tricarboxylic acid. Topological Polar Surface Area 171.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 11 Rotatable Bonds 17 Exact Mass 499.24176 Heavy Atoms 35 Complexity 513.0 InChI Key: JVKMHUAWFDGPTF-UHFFFAOYSA-N. SMILES: CCC(C1=CC=CC=C1)C(=O)OCCOCCN(CC)CC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.

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