13317-80-1

Basic information

• Product Name: methyl 5-phenylhexanoate
• Synonyms: methyl 5-phenylhexanoate
• CAS NO: 13317-80-1
• Molecular Weight: 206.285
• Mol File: 13317-80-1.mol
• Article Data: 5

Chemical Properties

• CAS DataBase Reference: methyl 5-phenylhexanoate(CAS DataBase Reference)
• NIST Chemistry Reference: methyl 5-phenylhexanoate(13317-80-1)
• EPA Substance Registry System: methyl 5-phenylhexanoate(13317-80-1)

Safety Data

• Hazardous Substances Data: 13317-80-1(Hazardous Substances Data)

Upstream product

• 67-56-1 methanol 
• 13984-50-4 methyl levulinate 
• 76024-08-3 cis-2-methoxy-6-methyltetrahydropyran 
• 98-86-2 acetophenone 
• 71-43-2 benzene 
• 13894-61-6 methyl (E)-hex-3-enoate 
• 1501-04-8 Methyl 4-benzoylbutanoate 
• 3128-06-1 5-ketohexanoic acid 
• 1501-05-9 5-oxo-5-phenylvaleric acid 
• 28525-63-5 5-phenylhex-4-enoic acid 
• 74312-59-7 (2E)-methyl 5-phenylhexa-2,4-dienoate 
• 14273-89-3 methyl 6-chlorohexanoate 
• 134953-18-7 methyl 5-phenylhex-4-enoate 

Downstream Products

• 74072-52-9 methyl 5-(4-acetylphenyl)hexanoate 
• 2972-25-0 5-phenylhexanoic acid 

Relevant articles and documents

Friedel-Crafts alkylation of benzene and toluene with olefinic C6 hydrocarbons and esters

To assist our study of the reaction of toluene and other aromatic compounds with methyl oleate and other olefinic esters, benzene and toluene have been alkylated under Friedel-Crafts conditions with hex-1-ene, hex-3-ene, methyl hex-3-enoate and methyl hex-3-enedioate. The products were isolated and identified by NMR and mass spectrometric procedures.

Some Aspects of the Chemistry of Benzosuberone: Novel synthesis of the 5,9-methano-5H-benzocycloheptene and 6,9-ethano-5H-benzocycloheptene ring systems.

5-Cyano-7-(dimethylamino)-5-phenylheptanoic acid (3; R1=H, R2=CN) and its derivatives could not be cyclised to benzosuberones but yielded with PPA, 3-(dimethylaminoethyl)-3-phenyl-2,7(1H)-dioxoazepane (6) and 6-(dimethylaminoethyl)-6

LIGHT-INDUCED FREE-RADICAL REACTIONS OF 2-METHOXY-6-METHYLTETRAHYDROPYRAN: IRREVERSIBLE RING OPENING AND MULTISITE HYDROGEN ABSTRACTION

Acetophenone-initiated photodegradation of cis-2-methoxy-4-methyltetrahydropyran (7) in benzene solvent produced six products.The structures of the products, and studies using optically active 7, showed that hydrogen abstraction occurs at both C-2 and C-6 of the tetrahydropyran ring.The products derived from the C-2 radical indicated two pathways for this radical: ring opening and loss of methyl, which is consistent with previous work on other similar systems.Results with optically active 7 showed that the ring-opening pathway is irreversible.Generation of an open-chain radical independently also showed that cyclization to a six membered ring does not occur.The products from the photodegradation were trans-2-methoxy-6-methyltetrahydropyran (8), methyl hexanoate (10), 6-methyltetrahydropyran-2-one (9), methyl 5-phenylhexanoate (11), 1,7-dimethyl-7-phenyl-6,8-dioxobicyclooctane (13), and 2-methoxy-2-(1-phenyl-1-hydroxyethyl)-6-methyltetrahydropyran (12).The yield of lactone 9 was found to be sensitive to the amount of residual oxygen present during the photolysis.