109162-29-0

Basic information

• Product Name: 1-BENZYL-HEXAHYDRO-4H-AZEPIN-4-OL
• Synonyms: 1-BENZYL-HEXAHYDRO-4H-AZEPIN-4-OL;1-BENZYL-4-HYDROXYAZEPANE;1-Benzylazepan-4-ol
• CAS NO: 109162-29-0
• Molecular Formula: C₁₃H₁₉NO
• Molecular Weight: 205.3
• Product Categories: pharmacetical
• Mol File: 109162-29-0.mol
• Article Data: 5

Chemical Properties

• Boiling Point: 325.2°Cat760mmHg
• Flash Point: 103.3°C
• Appearance: /
• Density: 1.077g/cm³
• Vapor Pressure: 9.53E-05mmHg at 25°C
• Refractive Index: 1.564
• CAS DataBase Reference: 1-BENZYL-HEXAHYDRO-4H-AZEPIN-4-OL(CAS DataBase Reference)
• NIST Chemistry Reference: 1-BENZYL-HEXAHYDRO-4H-AZEPIN-4-OL(109162-29-0)
• EPA Substance Registry System: 1-BENZYL-HEXAHYDRO-4H-AZEPIN-4-OL(109162-29-0)

Safety Data

• Hazardous Substances Data: 109162-29-0(Hazardous Substances Data)

Usage

Uses

Used in the preparation of N-heterocyclic ketones using ketoreductases READH and ChKRED20.

InChI:InChI=1/C13H19NO/c15-13-7-4-9-14(10-8-13)11-12-5-2-1-3-6-12/h1-3,5-6,13,15H,4,7-11H2

Upstream product

• 1208-75-9 1-benzylazepan-4-one 
• 1454-53-1 ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride 
• 109386-71-2 methyl 4-(N-benzyl-N-(2-methoxycarbonylethyl))aminobutyrate 
• 1164-14-3 ethyl 4-(N-benzyl-N-(2-ethoxycarbonylethyl))aminobutyrate 
• 23583-21-3 ethyl-3-benzylamino propionate 
• 23574-01-8 3-benzylamino-propionic acid methyl ester 
• 1208-76-0 1-benzyl-1,2,3,5,6,7-hexahydroazepine-4-one hydrochloride 
• 3612-20-2 1-phenylmethyl-4-piperidone 

Downstream Products

• 109386-81-4 1-benzyl-4-chloroperhydroazepine 
• 132525-76-9 1-benzyl-2-(2-chloroethyl)pyrrolidine 
• 109386-79-0 1-benzyl-4-chloroperhydroazepine hydrochloride 
• 895148-90-0 3-(1-benzyl-azepin-4-yl)-5,5-diphenyl-imidazolidine-2,4-dione 
• 478832-21-2 4-hydroxy-hexahydro-1H-azepine-1-carboxylic acid 1,1-dimethylethyl ester 
• 39888-51-2 azepan-4-ol 
• 109386-80-3 1-benzyl-1-azoniabicyclo<3.2.0>heptane chloride 

Relevant articles and documents

Stereo-complementary bioreduction of saturated N-heterocyclic ketones

The asymmetric bioreduction of several saturated N-heterocyclic ketones is demonstrated in a stereo-complementary fashion using the ketoreductases READH and ChKRED20 for the production of (S)- and (R)-alcohols, respectively. The reaction accepts substrates with a five-, six- or seven-membered ring, and exhibits excellent stereoselectivity when using 2-propanol as both the ultimate reducing agent and cosolvent, achieve >99% ee in the majority of cases for both enantiomers.

Rho KINASE INHIBITORS

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HETEROCYCLIC ETHERS DERIVED FROM 6,11-DIHYDRODIBENZOTHIEPIN-11-OLS AND 4,9-DIHYDROTHIENO-2-BENZOTHIEPIN-4-OL; A NEW SERIES OF POTENTIAL ANTIDEPRESSANTS AND ANTIHISTAMINE AGENTS

Reactions of 11-chloro-6,11-dihydrodibenzothiepin and methanesulfonates of 6,11-dihydrodibenzothiepin-11-ol (I), its 2-methyl derivative II and 4,9-dihydrothieno-2-benzothiepin-4-ol (III) with 1-methylpiperidin-4-ol, 1-methylperhydroazepin-4-ol (XIX), and tropine gave the ethers V-X.Their methanesulfonates were pharmacologically tested and showed antireserpine, anticataleptic, and antihistamine activities of various degree.The most active compounds were the ethers V and VI.