[4-(Dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl]propanoatenaphthalene-2-sulfonic acid

[4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] propanoate;naphthalene-2-sulfonic acid;hydrate

CAS: 5667-69-6

Molecular Formula	`C32H39NO6S`
Molecular Weight	565.7 g/mol
Topological Polar Surface Area	93.3 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	10
Exact Mass	565.2498
Heavy Atoms	40
Complexity	688.0

Chemical Identifiers

CAS Number	5667-69-6
SMILES	`CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O.O`
InChIKey	`GBKONKCASNNUQD-UHFFFAOYSA-N`

📖 Product Overview

[4-(Dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl]propanoatenaphthalene-2-sulfonic acid (CAS: 5667-69-6) is a chemical compound with molecular formula C32H39NO6S and molecular weight 565.7 g/mol. Its IUPAC systematic name is [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] propanoate;naphthalene-2-sulfonic acid;hydrate. Topological Polar Surface Area 93.3 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 7 Rotatable Bonds 10 Exact Mass 565.2498 Heavy Atoms 40 Complexity 688.0 InChI Key: GBKONKCASNNUQD-UHFFFAOYSA-N. SMILES: CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O.O.

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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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