[3-(3,4-dimethylphenyl)-4-ethoxy-3-ethoxycarbonyl-4-oxobutyl]azanium chloride

CAS: 67465-35-4

Molecular Formula	`C17H26ClNO4`
Molecular Weight	343.8 g/mol
Topological Polar Surface Area	80.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	9
Exact Mass	343.15503
Heavy Atoms	23
Complexity	365.0

Chemical Identifiers

CAS Number	67465-35-4
SMILES	`CCOC(=O)C(CC[NH3+])(C1=CC(=C(C=C1)C)C)C(=O)OCC.[Cl-]`
InChIKey	`ROLAMTQOOCIDSJ-UHFFFAOYSA-N`

📖 Product Overview

[3-(3,4-dimethylphenyl)-4-ethoxy-3-ethoxycarbonyl-4-oxobutyl]azanium chloride (CAS: 67465-35-4) is a chemical compound with molecular formula C17H26ClNO4 and molecular weight 343.8 g/mol. Its IUPAC systematic name is [3-(3,4-dimethylphenyl)-4-ethoxy-3-ethoxycarbonyl-4-oxobutyl]azanium chloride. Topological Polar Surface Area 80.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 9 Exact Mass 343.15503 Heavy Atoms 23 Complexity 365.0 InChI Key: ROLAMTQOOCIDSJ-UHFFFAOYSA-N. SMILES: CCOC(=O)C(CC[NH3+])(C1=CC(=C(C=C1)C)C)C(=O)OCC.[Cl-].

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