101100-86-1

Basic information

• Product Name: 1-(3,4-dimethoxy-phenyl)-heptan-1-one
• CAS NO: 101100-86-1
• Molecular Weight: 250.338
• Mol File: 101100-86-1.mol

Chemical Properties

• CAS DataBase Reference: 1-(3,4-dimethoxy-phenyl)-heptan-1-one(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(3,4-dimethoxy-phenyl)-heptan-1-one(101100-86-1)
• EPA Substance Registry System: 1-(3,4-dimethoxy-phenyl)-heptan-1-one(101100-86-1)

Safety Data

• Hazardous Substances Data: 101100-86-1(Hazardous Substances Data)

Upstream product

• 91-16-7 1,2-dimethoxybenzene 
• 111-14-8 oenanthic acid 
• 2528-61-2 Heptanoic acid chloride 

Downstream Products

• 101741-08-6 1-(2-heptyl-4,5-dimethoxy-phenyl)-ethanone 
• 132105-60-3 2-heptyl-4,5-dimethoxy-benzaldehyde 
• 2628-64-0 4-heptyl-pyrocatechol 
• 131568-28-0 4-heptyl-1,2-dimethoxybenzene 

Relevant articles and documents

Conception, characterization and correlation of new marine odorants

Via a synthetic sequence consisting of PPA-mediated Friedel-Crafts acylation of veratrol (8), Clemmensen reduction, demethylation with TMSI, Williamson ether synthesis employing 3-chloro-2-(chloromethyl)prop-1-ene and in-situ ruthenium tetroxide oxidation, numerous substituted benzo[b][1,4]dioxepinones 15-27 and 2,3-dihydro-1H-5,9-di-oxacyclohepta[f]indenones 7, 13 and 14 were prepared to study their odor-structure correlation. In the course of these studies, we discovered the extremely powerful new marine odorant 7-(3′ -methylbutyl)benzo[b][1,4]dioxepin-3-one (16). On the basis of the measured odor threshold data, an olfactophore model was constructed that rationalizes the observed odor intensities, and indicates an aliphatic hydrophobe at a distance of 6.3 A from the centre of the aromatic-ring binding site. Wiley-VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2003.