Benzoic acid, 3,4,5-trimethoxy-, 3-((3,3-diphenylpropyl)amino)propyl ester, hydrochloride

3,3-diphenylpropyl-[3-(3,4,5-trimethoxybenzoyl)oxypropyl]azanium chloride

CAS: 24050-58-6

Molecular Formula	`C28H34ClNO5`
Molecular Weight	500.0 g/mol
Topological Polar Surface Area	70.6 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	14
Exact Mass	499.21255
Heavy Atoms	35
Complexity	529.0

Chemical Identifiers

CAS Number	24050-58-6
SMILES	`COC1=CC(=CC(=C1OC)OC)C(=O)OCCC[NH2+]CCC(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]`
InChIKey	`YMKRGIWLUMQQED-UHFFFAOYSA-N`

📖 Product Overview

Benzoic acid, 3,4,5-trimethoxy-, 3-((3,3-diphenylpropyl)amino)propyl ester, hydrochloride (CAS: 24050-58-6) is a chemical compound with molecular formula C28H34ClNO5 and molecular weight 500.0 g/mol. Its IUPAC systematic name is 3,3-diphenylpropyl-[3-(3,4,5-trimethoxybenzoyl)oxypropyl]azanium chloride. Topological Polar Surface Area 70.6 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 14 Exact Mass 499.21255 Heavy Atoms 35 Complexity 529.0 InChI Key: YMKRGIWLUMQQED-UHFFFAOYSA-N. SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)OCCC[NH2+]CCC(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].

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