Coumarin, 7,8-dimethoxy-6-(2-hydroxy-3-isobutylaminopropoxy)-4-methyl-, hydrochloride

[3-(7,8-dimethoxy-4-methyl-2-oxochromen-6-yl)oxy-2-hydroxypropyl]-(2-methylpropyl)azanium chloride

CAS: 63446-04-8

Molecular Formula	`C19H28ClNO6`
Molecular Weight	401.9 g/mol
Topological Polar Surface Area	90.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	9
Exact Mass	401.16052
Heavy Atoms	27
Complexity	494.0

Chemical Identifiers

CAS Number	63446-04-8
SMILES	`CC1=CC(=O)OC2=C(C(=C(C=C12)OCC(C[NH2+]CC(C)C)O)OC)OC.[Cl-]`
InChIKey	`NXXKZYVYWUPSJG-UHFFFAOYSA-N`

📖 Product Overview

Coumarin, 7,8-dimethoxy-6-(2-hydroxy-3-isobutylaminopropoxy)-4-methyl-, hydrochloride (CAS: 63446-04-8) is a chemical compound with molecular formula C19H28ClNO6 and molecular weight 401.9 g/mol. Its IUPAC systematic name is [3-(7,8-dimethoxy-4-methyl-2-oxochromen-6-yl)oxy-2-hydroxypropyl]-(2-methylpropyl)azanium chloride. Topological Polar Surface Area 90.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 7 Rotatable Bonds 9 Exact Mass 401.16052 Heavy Atoms 27 Complexity 494.0 InChI Key: NXXKZYVYWUPSJG-UHFFFAOYSA-N. SMILES: CC1=CC(=O)OC2=C(C(=C(C=C12)OCC(C[NH2+]CC(C)C)O)OC)OC.[Cl-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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